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| CAS No.: | 73590-85-9 |
|---|---|
| Name: | Ufiprazole |
| Article Data: | 48 |
| Molecular Structure: | |
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| Formula: | C17H19N3O2S |
| Molecular Weight: | 329.423 |
| Synonyms: | 1H-Benzimidazole,5-methoxy-2-[[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]thio]- (9CI);2-[[(3,5-Dimethyl-4-methoxy-2-pyridyl)methyl]thio]-5-methoxy-1H-benzimidazole;2-[[(3,5-Dimethyl-4-methoxy-2-pyridyl)methyl]thio]-5-methoxybenzimidazole;5-Methoxy-2-[[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]thio]-1H-benzimidazole;5-Methoxy-2-[[(4-methoxy-3,5-dimethyl-2-pyridyl)methyl]thio]-1H-benzimidazole;H 168/22;Omeprazole sulfide;Pyrmetazole; |
| EINECS: | 208-591-9 |
| Density: | 1.28 g/cm3 |
| Melting Point: | 122.0 to 126.0 °C |
| Boiling Point: | 539.7 °C at 760 mmHg |
| Flash Point: | 280.2 °C |
| Hazard Symbols: | Xi |
| Risk Codes: | 36/37/38 |
| Safety: | 26 |
| PSA: | 85.33000 |
| LogP: | 3.88420 |
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Chemistry
IUPAC Name: 6-Methoxy-2-[(4-methoxy-3,5-dimethylpyridin-2-yl)methylsulfanyl]-1H-benzimidazole
Following is the structure of 1H-Benzimidazole,6-methoxy-2-[[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]thio]- (CAS NO.73590-85-9):
Empirical Formula: C17H19N3O2S
Molecular Weight: 329.4167 g/mol
Molar Refractivity: 93.16 cm3
Molar Volume: 255.5 cm3
Density: 1.28 g/cm3
Flash Point: 280.2 °C
Index of Refraction: 1.649
Surface Tension: 63.3 dyne/cm
Enthalpy of Vaporization: 81.71 kJ/mol
Boiling Point: 539.7 °C at 760 mmHg
Vapour Pressure of 1H-Benzimidazole,6-methoxy-2-[[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]thio]- (CAS NO.73590-85-9): 1.03E-11 mmHg at 25 °C
Product Categories of 1H-Benzimidazole,6-methoxy-2-[[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]thio]- (CAS NO.73590-85-9): (intermediate of lamivudine); Various Metabolites and Impurities; Intermediates & Fine Chemicals; Metabolites; Pharmaceuticals
Canonical SMILES: CC1=CN=C(C(=C1OC)C)CSC2=NC3=C(N2)C=C(C=C3)OC
InChI: InChI=1S/C17H19N3O2S/c1-10-8-18-15(11(2)16(10)22-4)9-23-17-19-13-6-5-12(21-3)7-14(13)20-17/h5-8H,9H2,1-4H3,(H,19,20)
InChIKey: XURCIPRUUASYLR-UHFFFAOYSA-N
Uses
1H-Benzimidazole,6-methoxy-2-[[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]thio]- (CAS NO.73590-85-9) can be used as a metabolite of Omeprazole .
Specification
1H-Benzimidazole,6-methoxy-2-[[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]thio]- , its cas register number is 73590-85-9. It also can be called 2-{[(3,5-Dimethyl-4-methoxy-2-pyridinyl)-methyl]-thio}-5-methoxy-1H-benzimidazole ; and Ufiprazole .