C34H39N3O8 Cytidine, 5′-O-[bis(4-methoxyphenyl)phenylmethyl]-2′-O-(2-methox yethyl)-5-methyl- (9CI, ACI)

bidhaa

C34H39N3O8 Cytidine, 5′-O-[bis(4-methoxyphenyl)phenylmethyl]-2′-O-(2-methox yethyl)-5-methyl- (9CI, ACI)

Taarifa za Msingi:


Maelezo ya Bidhaa

Lebo za Bidhaa

Tabia za kimwili

Sifa Muhimu za Kimwili Thamani Hali
Uzito wa Masi 617.69 -
Kiwango cha Kuchemka (Iliyotabiriwa) 762.6±70.0 °C Bonyeza: 760 Torr
Msongamano (Uliotabiriwa) 1.27±0.1 g/cm3 Joto: 20 ° C; Bonyeza: 760 Torr
pKa (Iliyotabiriwa) 13.31±0.70 Halijoto ya Asidi Zaidi: 25 °C

Majina Mengine na Vitambulisho

TABASAMU za Kikanuni O=C1N=C(N)C(=CN1C2OC(COC(C=3C=CC=CC3)(C4=CC=C(OC)C=C4)C5=CC=C(OC)C=C5) C(O)C2OCCOC)C
Isomeric SMILES C(OC[C@H]1O[C@H]([C@H](OCCOC)[C@@H]1O)N2C(=O)N=C(N)C(C)=C2 )(C3=CC=C(OC)C=C3)(C4=CC=C(OC)C=C4)C5=CC=CC=C5
InChI
InChI=1S/C34H39N3O8/c1-22-20-37(33(39)36-31(22)35)32-30(43-19-18-40-2)29(38)28(45-32) 21-44-34(23-8-6-5-7-9-23,24-10-14-26(4 1-3)15-11-24)25-12-16-27(42-4) )17-13-25/h5-17,20,28-30,32,38H,18-19,21H2,1-4H3,(H2,35,36,39)/t28-,29-,30-, 32-/m1/s1
Ufunguo wa InChi
LYKTVJJXZQTNPK-PBAMLIMUSA-N
24 Majina Mengine ya Dawa hii
5′-O-[Bis(4-methoxyphenyl)phenylmethyl]-2′-O-(2-methoxyethyl)-5-methylcytidine (ACI); 11: PN: US20030170636 UKURASA: 17 walidai RNA; 12: PN: US20030211606 UKURASA: 18 alidai R NA; 12: PN: US20030212017 UKURASA: 19 alidai R NA; 14: PN: US20040005569 UKURASA E: 21 inadaiwa R NA; 15: PN: US20040005565 UKURASA: 17- 22 alidai RNA; 15: PN: US20040005570 UKURASA: 19 alidai R NA; 15: PN: U S20040006030 UKURASA: 22 alidai R NA; 15: PN: US20040014048 UKURASA: 19 alidai R NA; 16: PN: US20030171313 UKURASA: 9 walidai RNA; 16: PN: US20030198965 UKURASA: 19 alidai R NA; 16: PN: US20040014047 UKURASA: 19 alidai R NA; 16: PN: US20040014049 UKURASA:

19 ilidai RNA; 17: PN: US20040014051 UKURASA: 21 alidai R NA; 17: PN: US20040014699 UKURASA: 19 alidai R NA; 17: PN: W
O03106645 UKURASA: 69 alidai R NA; 18: PN: US20040006029 UKURASA: 22 alidai R NA; 2'-O-Methoxyethyl-5'-O-dimethoxytrityl-5- methylcytidine; 58: PN: US20030166592 UKURASA: 15 alidai R NA; 5: PN: WO2005006958 UKURASA: 61 alidai R NA; 7: PN: WO20050 07825 UKURASA: 61 alidai R NA; 82: PN: US20040171566 UKURASA: 18 walidai R NA; 89: PN: US20040005707 UKURASA: 19 walidai R NA; 9: PN: WO03084478 UKURASA: 56 alidai R NA

Mali Zilizotabiriwa

Mali zinazopatikana
Kibiolojia
Kemikali
Msongamano
Lipinski
Kuhusiana na Muundo
Joto

Kibiolojia

Mali Thamani Hali Chanzo
Kipengele cha Mkusanyiko wa Kibiolojia 1.56 pH 1; Joto: 25 °C (1) ACD
Kipengele cha Mkusanyiko wa Kibiolojia 1.99 pH 2; Joto: 25 °C (1) ACD
Kipengele cha Mkusanyiko wa Kibiolojia 6.19 pH 3; Joto: 25 °C (1) ACD
Kipengele cha Mkusanyiko wa Kibiolojia 38.0 pH 4; Joto: 25 °C (1) ACD
Kipengele cha Mkusanyiko wa Kibiolojia 116 pH 5; Joto: 25 °C (1) ACD
Kipengele cha Mkusanyiko wa Kibiolojia 146 pH 6; Joto: 25 °C (1) ACD
Kipengele cha Mkusanyiko wa Kibiolojia 150 pH 7; Joto: 25 °C (1) ACD
Kipengele cha Mkusanyiko wa Kibiolojia 151 pH 8; Joto: 25 °C (1) ACD
Kipengele cha Mkusanyiko wa Kibiolojia 151 pH 9; Joto: 25 °C (1) ACD
Kipengele cha Mkusanyiko wa Kibiolojia 151 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 13.0 pH 1; Joto: 25 °C (1) ACD
Koc 16.6 pH 2; Joto: 25 °C (1) ACD
Koc 51.8 pH 3; Joto: 25 °C (1) ACD
Koc 318 pH 4; Joto: 25 °C (1) ACD
Koc 966 pH 5; Joto: 25 °C (1) ACD
Koc 1220 pH 6; Joto: 25 °C (1) ACD
Koc 1260 pH 7; Joto: 25 °C (1) ACD

 

Mali Thamani Hali Chanzo
Koc 1260 pH 8; Joto: 25 °C (1) ACD
Koc 1260 pH 9; Joto: 25 °C (1) ACD
Koc 1260 pH 10; Joto: 25 °C (1) ACD
logD 1.18 pH 1; Joto: 25 °C (1) ACD
logD 1.29 pH 2; Joto: 25 °C (1) ACD
logD 1.78 pH 3; Joto: 25 °C (1) ACD
logD 2.57 pH 4; Joto: 25 °C (1) ACD
logD 3.05 pH 5; Joto: 25 °C (1) ACD
logD 3.16 pH 6; Joto: 25 °C (1) ACD
logD 3.17 pH 7; Joto: 25 °C (1) ACD
logD 3.17 pH 8; Joto: 25 °C (1) ACD
logD 3.17 pH 9; Joto: 25 °C (1) ACD
logD 3.17 pH 10; Joto: 25 °C (1) ACD
logP 3.169±0.598 Joto: 25 °C (1) ACD
Umumunyifu wa Ndani wa Misa 5.2 x 10-3 g/L Joto: 25 °C (1) ACD
Umumunyifu wa Misa 0.51 g/L pH 1; Joto: 25 °C (1) ACD
Umumunyifu wa Misa 0.40 g/L pH 2; Joto: 25 °C (1) ACD
Umumunyifu wa Misa 0.13 g/L pH 3; Joto: 25 °C (1) ACD
Umumunyifu wa Misa 0.020 g/L pH 4; Joto: 25 °C (1) ACD
Umumunyifu wa Misa 6.8 x 10-3 g/L pH 5; Joto: 25 °C (1) ACD
Umumunyifu wa Misa 5.4 x 10-3 g/L pH 6; Joto: 25 °C (1) ACD
Umumunyifu wa Misa 5.3 x 10-3 g/L pH 7; Joto: 25 °C (1) ACD
Umumunyifu wa Misa 5.2 x 10-3 g/L pH 8; Joto: 25 °C (1) ACD
Umumunyifu wa Misa 5.2 x 10-3 g/L pH 9; Joto: 25 °C (1) ACD
Umumunyifu wa Misa 5.2 x 10-3 g/L pH 10; Joto: 25 °C (1) ACD
Umumunyifu wa Misa 5.3 x 10-3 g/L Maji yasio na buffered pH 7.05; Joto: 25 °C (1) ACD
Umumunyifu wa Ndani wa Molar 8.4 x 10-6 mol/L Joto: 25 °C (1) ACD
Umumunyifu wa Molar 8.2 x 10-4 mol/L pH 1; Joto: 25 °C (1) ACD
Umumunyifu wa Molar 6.4 x 10-4 mol/L pH 2; Joto: 25 °C (1) ACD
Umumunyifu wa Molar 2.1 x 10-4 mol/L pH 3; Joto: 25 °C (1) ACD
Umumunyifu wa Molar 3.3 x 10-5 mol/L pH 4; Joto: 25 °C (1) ACD
Umumunyifu wa Molar 1.1 x 10-5 mol/L pH 5; Joto: 25 °C (1) ACD

 

Mali Thamani Hali Chanzo
Umumunyifu wa Molar 8.7 x 10-6 mol/L pH 6; Joto: 25 °C (1) ACD
Umumunyifu wa Molar 8.5 x 10-6 mol/L pH 7; Joto: 25 °C (1) ACD
Umumunyifu wa Molar 8.4 x 10-6 mol/L pH 8; Joto: 25 °C (1) ACD
Umumunyifu wa Molar 8.4 x 10-6 mol/L pH 9; Joto: 25 °C (1) ACD
Umumunyifu wa Molar 8.4 x 10-6 mol/L pH 10; Joto: 25 °C (1) ACD
Umumunyifu wa Molar 8.5 x 10-6 mol/L Maji yasio na buffered pH 7.05; Joto: 25 °C (1) ACD
Uzito wa Masi 617.69    
pKa 13.31±0.70 Halijoto ya Asidi Zaidi: 25 °C (1) ACD
pKa 4.58±0.10 Joto la Msingi Zaidi: 25 °C (1) ACD
Shinikizo la Mvuke 1.89 x 10-24 Torr Joto: 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 1.27±0.1 g/cm3 Joto: 20 ° C; Bonyeza: 760 Torr (1) ACD
Kiasi cha Molar 483.8±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 14   (1) ACD
H Wapokeaji 11   (1) ACD
H Wafadhili 3   (1) ACD
H Jumla ya Mfadhili/Mpokeaji 14   (1) ACD
logP 3.169±0.598 Joto: 25 °C (1) ACD
Uzito wa Masi 617.69    

(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 134 A2 (1) ACD

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

Joto

Mali Thamani Hali Chanzo
Kiwango cha kuchemsha 762.6±70.0 °C Bonyeza: 760 Torr (1) ACD
Enthalpy ya vaporization 116.53±3.0 kJ/mol Bonyeza: 760 Torr (1) ACD
Kiwango cha Kiwango 415.0±35.7 °C   (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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