![C39H37N5O7 Adenosine, N-benzoyl-5′-O-[bis(4-methoxyphenyl)phenylmethyl]-2′- O-methyl- (9CI, ACI)](http://cdn.globalso.com/nvchem/style/global/img/demo/page_banner.jpg)
![C39H37N5O7 Adenosine, N-benzoyl-5′-O-[bis(4-methoxyphenyl)phenylmethyl]-2′- O-methyl- (9CI, ACI) Picha Iliyoangaziwa](https://cdn.globalso.com/nvchem/Substance-Detail.jpg)
C39H37N5O7 Adenosine, N-benzoyl-5′-O-[bis(4-methoxyphenyl)phenylmethyl]-2′- O-methyl- (9CI, ACI)
| Sifa Muhimu za Kimwili | Thamani | Hali |
| Uzito wa Masi | 687.74 | - |
| Msongamano (Uliotabiriwa) | 1.32±0.1 g/cm3 | Joto: 20 ° C; Bonyeza: 760 Torr |
| pKa (Iliyotabiriwa) | 7.87±0.43 | Halijoto ya Asidi Zaidi: 25 °C |
TABASAMU za Kisheria O=C(NC1=NC=NC2=C1N=CN2C3OC(COC(C=4C=CC=CC4)(C5=CC=C(OC)C=C5)C6=CC=C(OC)C=C6 )C(O)C3OC)C=7C=CC=CC7
Isomeric TABASAMU
C(OC[C@H]1O[C@H]([C@H](OC)[C@@H]1O)N2C=3C(N=C2)=C(NC(=O)C4=CC =CC=C4)N=CN3)(C5=CC=C(OC)C=C5)(C6=CC=C(OC)C=C6) C7=CC=CC=C7
InChI
InChI=1S/C39H37N5O7/c1-47-29-18-14-27(15-19-29)39(26-12-8-5-9-13-26,28-16-20-30(48-) 2)21-17-28)50-22-31-33(45)34(49-3)38(51- 31)44-24-42-32-35(40-23-41-36(32) 44)43-37(46)25-10-6-4-7-11-25/h4-21,23-24,31,33-34,38,45H,22H2,1-3H3,(H,40 ,41,43,46)/t31-,33-,
34-,38-/m1/s1
Ufunguo wa InChI
SAHDAQOZNKZCC-CJEGOSRCSA-N
1 Jina Lingine la Dawa hii
N-Benzoyl-5′-O-[bis(4-methoxyphenyl)phenylmethyl]-2′-O-methyladenosine (ACI)
Spectra inapatikana
1H NMR
13C NMR
Misa
Mali zinazopatikana
Kibiolojia
Kemikali
Msongamano
Lipinski
Kuhusiana na Muundo
Kibiolojia
| Mali | Thamani | Hali | Chanzo |
| Kipengele cha Mkusanyiko wa Kibiolojia | 47800 | pH 1; Joto: 25 °C | (1) ACD |
| Kipengele cha Mkusanyiko wa Kibiolojia | 1.63 x 105 | pH 2; Joto: 25 °C | (1) ACD |
| Kipengele cha Mkusanyiko wa Kibiolojia | 2.16 x 105 | pH 3; Joto: 25 °C | (1) ACD |
| Kipengele cha Mkusanyiko wa Kibiolojia | 2.23 x 105 | pH 4; Joto: 25 °C | (1) ACD |
| Kipengele cha Mkusanyiko wa Kibiolojia | 2.23 x 105 | pH 5; Joto: 25 °C | (1) ACD |
| Kipengele cha Mkusanyiko wa Kibiolojia | 2.18 x 105 | pH 6; Joto: 25 °C | (1) ACD |
| Kipengele cha Mkusanyiko wa Kibiolojia | 1.79 x 105 | pH 7; Joto: 25 °C | (1) ACD |
| Kipengele cha Mkusanyiko wa Kibiolojia | 64900 | pH 8; Joto: 25 °C | (1) ACD |
| Kipengele cha Mkusanyiko wa Kibiolojia | 10600 | pH 9; Joto: 25 °C | (1) ACD |
| Kipengele cha Mkusanyiko wa Kibiolojia | 3110 | pH 10; Joto: 25 °C | (1) ACD |
(1) Imekokotolewa kwa kutumia Advanced Kemia Development (ACD/Labs) Programu V11.02 (© 1994-2023 ACD/Labs)
Kemikali
| Mali | Thamani | Hali | Chanzo |
| Koc | 50200 | pH 1; Joto: 25 °C | (1) ACD |
| Koc | 1.71 x 105 | pH 2; Joto: 25 °C | (1) ACD |
| Koc | 2.26 x 105 | pH 3; Joto: 25 °C | (1) ACD |
| Koc | 2.34 x 105 | pH 4; Joto: 25 °C | (1) ACD |
| Koc | 2.34 x 105 | pH 5; Joto: 25 °C | (1) ACD |
| Koc | 2.29 x 105 | pH 6; Joto: 25 °C | (1) ACD |
| Koc | 1.88 x 105 | pH 7; Joto: 25 °C | (1) ACD |
| Mali | Thamani | Hali | Chanzo |
| Koc | 68000 | pH 8; Joto: 25 °C | (1) ACD |
| Koc | 11200 | pH 9; Joto: 25 °C | (1) ACD |
| Koc | 3260 | pH 10; Joto: 25 °C | (1) ACD |
| logD | 6.67 | pH 1; Joto: 25 °C | (1) ACD |
| logD | 7.21 | pH 2; Joto: 25 °C | (1) ACD |
| logD | 7.33 | pH 3; Joto: 25 °C | (1) ACD |
| logD | 7.34 | pH 4; Joto: 25 °C | (1) ACD |
| logD | 7.34 | pH 5; Joto: 25 °C | (1) ACD |
| logD | 7.33 | pH 6; Joto: 25 °C | (1) ACD |
| logD | 7.25 | pH 7; Joto: 25 °C | (1) ACD |
| logD | 6.80 | pH 8; Joto: 25 °C | (1) ACD |
| logD | 6.02 | pH 9; Joto: 25 °C | (1) ACD |
| logD | 5.49 | pH 10; Joto: 25 °C | (1) ACD |
| logP | 7.344±0.723 | Joto: 25 °C | (1) ACD |
| Umumunyifu wa Ndani wa Misa | 2.7 x 10-6 g/L | Joto: 25 °C | (1) ACD |
| Umumunyifu wa Misa | 1.2 x 10-5 g/L | pH 1; Joto: 25 °C | (1) ACD |
| Umumunyifu wa Misa | 3.7 x 10-6 g/L | pH 2; Joto: 25 °C | (1) ACD |
| Umumunyifu wa Misa | 2.8 x 10-6 g/L | pH 3; Joto: 25 °C | (1) ACD |
| Umumunyifu wa Misa | 2.8 x 10-6 g/L | pH 4; Joto: 25 °C | (1) ACD |
| Umumunyifu wa Misa | 2.8 x 10-6 g/L | pH 5; Joto: 25 °C | (1) ACD |
| Umumunyifu wa Misa | 2.8 x 10-6 g/L | pH 6; Joto: 25 °C | (1) ACD |
| Umumunyifu wa Misa | 3.4 x 10-6 g/L | pH 7; Joto: 25 °C | (1) ACD |
| Umumunyifu wa Misa | 9.6 x 10-6 g/L | pH 8; Joto: 25 °C | (1) ACD |
| Umumunyifu wa Misa | 5.7 x 10-5 g/L | pH 9; Joto: 25 °C | (1) ACD |
| Umumunyifu wa Misa | 1.9 x 10-4 g/L | pH 10; Joto: 25 °C | (1) ACD |
| Umumunyifu wa Misa | 3.4 x 10-6 g/L | Maji yasiyo na buffered pH 7.00; Joto: 25 °C | (1) ACD |
| Umumunyifu wa Ndani wa Molar | 3.9 x 10-9 mol/L | Joto: 25 °C | (1) ACD |
| Umumunyifu wa Molar | 1.8 x 10-8 mol/L | pH 1; Joto: 25 °C | (1) ACD |
| Umumunyifu wa Molar | 5.4 x 10-9 mol/L | pH 2; Joto: 25 °C | (1) ACD |
| Umumunyifu wa Molar | 4.1 x 10-9 mol/L | pH 3; Joto: 25 °C | (1) ACD |
| Umumunyifu wa Molar | 4.0 x 10-9 mol/L | pH 4; Joto: 25 °C | (1) ACD |
| Umumunyifu wa Molar | 4.0 x 10-9 mol/L | pH 5; Joto: 25 °C | (1) ACD |
| Mali | Thamani | Hali | Chanzo |
| Umumunyifu wa Molar | 4.0 x 10-9 mol/L | pH 6; Joto: 25 °C | (1) ACD |
| Umumunyifu wa Molar | 4.9 x 10-9 mol/L | pH 7; Joto: 25 °C | (1) ACD |
| Umumunyifu wa Molar | 1.4 x 10-8 mol/L | pH 8; Joto: 25 °C | (1) ACD |
| Umumunyifu wa Molar | 8.3 x 10-8 mol/L | pH 9; Joto: 25 °C | (1) ACD |
| Umumunyifu wa Molar | 2.8 x 10-7 mol/L | pH 10; Joto: 25 °C | (1) ACD |
| Umumunyifu wa Molar | 4.9 x 10-9 mol/L | Maji yasiyo na buffered pH 7.00; Joto: 25 °C | (1) ACD |
| Uzito wa Masi | 687.74 | ||
| pKa | 7.87±0.43 | Halijoto ya Asidi Zaidi: 25 °C | (1) ACD |
| pKa | 1.39±0.10 | Joto la Msingi Zaidi: 25 °C | (1) ACD |
(1) Imekokotolewa kwa kutumia Advanced Kemia Development (ACD/Labs) Programu V11.02 (© 1994-2023 ACD/Labs)
Msongamano
| Mali | Thamani | Hali | Chanzo |
| Msongamano | 1.32±0.1 g/cm3 | Joto: 20 ° C; Bonyeza: 760 Torr | (1) ACD |
| Kiasi cha Molar | 518.5±7.0 cm3/mol | Joto: 20 ° C; Bonyeza: 760 Torr | (1) ACD |
(1) Imekokotolewa kwa kutumia Advanced Kemia Development (ACD/Labs) Programu V11.02 (© 1994-2023 ACD/Labs)
Lipinski
| Mali | Thamani | Hali | Chanzo |
| Vifungo vinavyoweza kuzungushwa kwa Uhuru | 12 | (1) ACD | |
| H Wakubali | 12 | (1) ACD | |
| H Wafadhili | 2 | (1) ACD | |
| H Jumla ya Mfadhili/Mpokeaji | 14 | (1) ACD | |
| logP | 7.344±0.723 | Joto: 25 °C | (1) ACD |
| Uzito wa Masi | 687.74 |
(1) Imekokotolewa kwa kutumia Advanced Kemia Development (ACD/Labs) Programu V11.02 (© 1994-2023 ACD/Labs)
Kuhusiana na Muundo
| Mali | Thamani | Hali | Chanzo |
| Eneo la Uso wa Polar | 139 A2 | (1) ACD | |
(1) Imekokotolewa kwa kutumia Advanced Kemia Development (ACD/Labs) Programu V11.02 (© 1994-2023 ACD/Labs)
Spectra inapatikana
1H NMR
Spectra inapatikana
13C NMR
![C34H39N3O8 Cytidine, 5′-O-[bis(4-methoxyphenyl)phenylmethyl]-2′-O-(2-methox yethyl)-5-methyl- (9CI, ACI)](https://cdn.globalso.com/nvchem/C34H39N3O8-Cytidine-300x300.jpg)
![C47H60N7O10P Guanosine, 5′ -O- [bis(4-methoxyphenyl)phenylmethyl]-2′ -O-(2- methoxyethyl)-N-(2-methyl-1-oxopropyl)-, 3′ – [2-cyanoethyl N ,N-bis (1-methylethyl)phosphoramidite] (ACI)](https://cdn.globalso.com/nvchem/C47H60N7O10P-Guanosine-300x300.png)
![C41H49FN5O8P Cytidine, N-acetyl-5′ -O- [bis(4-methoxyphenyl)phenylmethyl]-2′ – deoxy-2′ -fluoro-, 3′ – [2-cyanoethyl N,N-bis(1-methylethyl) fosforasi amidite] (ACI)](https://cdn.globalso.com/nvchem/C41H49FN5O8P-Cytidine-300x300.png)
![C44H49N5O7Si Adenosine, N-benzoyl-5′-O-[bis(4-methoxyphenyl)phenylmethyl]-2′- O-[(1,1-dimethylethyl)dimethylsilyl]- (9CI, ACI)](https://cdn.globalso.com/nvchem/C44H49N5O7Si-Adenosine-300x300.jpg)
