C33H35N3O8 Cytidine, N-asetili-5′-O-[bis(4-methoxyphenyl)phenylmethyl]-2′-O- methyl- (9CI, ACI)

bidhaa

C33H35N3O8 Cytidine, N-asetili-5′-O-[bis(4-methoxyphenyl)phenylmethyl]-2′-O- methyl- (9CI, ACI)

Taarifa za Msingi:


Maelezo ya Bidhaa

Lebo za Bidhaa

Tabia za kimwili

Sifa Muhimu za Kimwili Thamani Hali
Uzito wa Masi 601.65 -
Msongamano (Uliotabiriwa) 1.28±0.1 g/cm3 Joto: 20 ° C;Bonyeza: 760 Torr
pKa (Iliyotabiriwa) 10.19±0.20 Halijoto ya Asidi Zaidi: 25 °C

Majina Mengine na Vitambulisho

TABASAMU za Kikanuni O=C1N=C(C=CN1C2OC(COC(C=3C=CC=CC3)(C4=CC=C(OC)C=C4)C5=CC=C(OC)C=C5)C(O )C2OC)NC(=O)C
Isomeric SMILES C(OC[C@H]1O[C@H]([C@H](OC)[C@@H]1O)N2C(=O)N=C(NC(C)=O)C =C2)(C3=CC=C(OC)C=C3)(C4=CC=C(OC)C=C4)C5=CC=CC=C5
InChI
InChI=1S/C33H35N3O8/c1-21(37)34-28-18-19-36(32(39)35-28)31-30(42-4)29(38)27(44-31)20- 43-33(22-8-6-5-7-9-22,23-10-14-25(40-2) 15-11-23)24-12-16-26(41-3)17- 13-24/h5-19,27,29-31,38H,20H2,1-4H3,(H,34,35,37,39)/t27-,29-,30-,31-/m1/s1
Ufunguo wa InChi
FINUHOJILDNELQ-PMFUCWTESA-N
1 Jina Lingine la Dawa hii
N-Asetili-5′-O-[bis(4-methoxyphenyl)phenylmethyl]-2′-O-methylcytidine (ACI)

Mali Zilizotabiriwa

Mali zinazopatikana
Kibiolojia
Kemikali
Msongamano
Lipinski
Kuhusiana na Muundo

Kibiolojia

Mali Thamani Hali Chanzo
Kipengele cha Mkusanyiko wa Kibiolojia 8.87 pH 1;Joto: 25 °C (1) ACD
Kipengele cha Mkusanyiko wa Kibiolojia 27.8 pH 2;Joto: 25 °C (1) ACD
Kipengele cha Mkusanyiko wa Kibiolojia 171 pH 3;Joto: 25 °C (1) ACD
Kipengele cha Mkusanyiko wa Kibiolojia 515 pH 4;Joto: 25 °C (1) ACD
Kipengele cha Mkusanyiko wa Kibiolojia 650 pH 5;Joto: 25 °C (1) ACD
Kipengele cha Mkusanyiko wa Kibiolojia 668 pH 6;Joto: 25 °C (1) ACD
Kipengele cha Mkusanyiko wa Kibiolojia 668 pH 7;Joto: 25 °C (1) ACD
Kipengele cha Mkusanyiko wa Kibiolojia 657 pH 8;Joto: 25 °C (1) ACD
Kipengele cha Mkusanyiko wa Kibiolojia 560 pH 9;Joto: 25 °C (1) ACD
Kipengele cha Mkusanyiko wa Kibiolojia 229 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 48.6 pH 1;Joto: 25 °C (1) ACD
Koc 152 pH 2;Joto: 25 °C (1) ACD
Koc 935 pH 3;Joto: 25 °C (1) ACD
Koc 2820 pH 4;Joto: 25 °C (1) ACD
Koc 3560 pH 5;Joto: 25 °C (1) ACD
Koc 3660 pH 6;Joto: 25 °C (1) ACD
Koc 3660 pH 7;Joto: 25 °C (1) ACD
Koc 3600 pH 8;Joto: 25 °C (1) ACD
Koc 3070 pH 9;Joto: 25 °C (1) ACD
Koc 1250 pH 10;Joto: 25 °C (1) ACD
logD 2.14 pH 1;Joto: 25 °C (1) ACD
logD 2.64 pH 2;Joto: 25 °C (1) ACD

 

Mali Thamani Hali Chanzo
logD 3.43 pH 3;Joto: 25 °C (1) ACD
logD 3.91 pH 4;Joto: 25 °C (1) ACD
logD 4.01 pH 5;Joto: 25 °C (1) ACD
logD 4.02 pH 6;Joto: 25 °C (1) ACD
logD 4.02 pH 7;Joto: 25 °C (1) ACD
logD 4.01 pH 8;Joto: 25 °C (1) ACD
logD 3.94 pH 9;Joto: 25 °C (1) ACD
logD 3.55 pH 10;Joto: 25 °C (1) ACD
logP 4.021±0.768 Joto: 25 °C (1) ACD
Umumunyifu wa Ndani wa Misa 1.3 x 10-3 g/L Joto: 25 °C (1) ACD
Umumunyifu wa Misa 0.10 g/L pH 1;Joto: 25 °C (1) ACD
Umumunyifu wa Misa 0.032 g/L pH 2;Joto: 25 °C (1) ACD
Umumunyifu wa Misa 5.2 x 10-3 g/L pH 3;Joto: 25 °C (1) ACD
Umumunyifu wa Misa 1.7 x 10-3 g/L pH 4;Joto: 25 °C (1) ACD
Umumunyifu wa Misa 1.4 x 10-3 g/L pH 5;Joto: 25 °C (1) ACD
Umumunyifu wa Misa 1.3 x 10-3 g/L pH 6;Joto: 25 °C (1) ACD
Umumunyifu wa Misa 1.3 x 10-3 g/L pH 7;Joto: 25 °C (1) ACD
Umumunyifu wa Misa 1.3 x 10-3 g/L pH 8;Joto: 25 °C (1) ACD
Umumunyifu wa Misa 1.6 x 10-3 g/L pH 9;Joto: 25 °C (1) ACD
Umumunyifu wa Misa 3.9 x 10-3 g/L pH 10;Joto: 25 °C (1) ACD
Umumunyifu wa Misa 1.3 x 10-3 g/L Maji yasio na buffered pH 6.99;Joto: 25 °C (1) ACD
Umumunyifu wa Ndani wa Molar 2.2 x 10-6 mol/L Joto: 25 °C (1) ACD
Umumunyifu wa Molar 1.7 x 10-4 mol/L pH 1;Joto: 25 °C (1) ACD
Umumunyifu wa Molar 5.3 x 10-5 mol/L pH 2;Joto: 25 °C (1) ACD
Umumunyifu wa Molar 8.6 x 10-6 mol/L pH 3;Joto: 25 °C (1) ACD
Umumunyifu wa Molar 2.9 x 10-6 mol/L pH 4;Joto: 25 °C (1) ACD
Umumunyifu wa Molar 2.3 x 10-6 mol/L pH 5;Joto: 25 °C (1) ACD
Umumunyifu wa Molar 2.2 x 10-6 mol/L pH 6;Joto: 25 °C (1) ACD
Umumunyifu wa Molar 2.2 x 10-6 mol/L pH 7;Joto: 25 °C (1) ACD
Umumunyifu wa Molar 2.2 x 10-6 mol/L pH 8;Joto: 25 °C (1) ACD
Umumunyifu wa Molar 2.6 x 10-6 mol/L pH 9;Joto: 25 °C (1) ACD
Umumunyifu wa Molar 6.4 x 10-6 mol/L pH 10;Joto: 25 °C (1) ACD

 

Mali Thamani Hali Chanzo
Umumunyifu wa Molar 2.2 x 10-6 mol/L Maji yasio na buffered pH 6.99;Joto: 25 °C (1) ACD
Uzito wa Masi 601.65    
pKa 10.19±0.20 Halijoto ya Asidi Zaidi: 25 °C (1) ACD
pKa 3.57±0.20 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 1.28±0.1 g/cm3 Joto: 20 ° C;Bonyeza: 760 Torr (1) ACD
Kiasi cha Molar 466.5±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 11   (1) ACD
H Wakubali 11   (1) ACD
H Wafadhili 2   (1) ACD
H Jumla ya Mfadhili/Mpokeaji 13   (1) ACD
logP 4.021±0.768 Joto: 25 °C (1) ACD
Uzito wa Masi 601.65    

(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 128 A2 (1) ACD

(1) Imekokotolewa kwa kutumia Advanced Kemia Development (ACD/Labs) Programu V11.02 (© 1994-2023 ACD/Labs)

Spectra iliyotabiriwa

Spectra inapatikana
1H NMR
13C NMR


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