Basic information
- CAS
117846-02-3- Standard SMILES
CN(C)Cc1ccc(CSCCNC(=O)C[N+](=O)[O-])o1- InChIKey
PFYRWZJFERNHFP-UHFFFAOYSA-N- Molecular formula
- C12H19N3O4S
- Average molar mass
- 301.36 g/mol
Names & identifiers
- Preferred name
- N-(2-(((5-((Dimethylamino)methyl)furan-2-yl)methyl)sulfanyl)ethyl)-2-nitroacetamide
- IUPAC
- N-[2-[[5-[(dimethylamino)methyl]furan-2-yl]methylsulfanyl]ethyl]-2-nitroacetamide
- English name
- Ranitidine
- Molecular formula
- C12H19N3O4S
- Molecular weight
- 301.36
Names & synonyms
117846-02-3N-(2-(((5-((Dimethylamino)methyl)furan-2-yl)methyl)sulfanyl)ethyl)-2-nitroacetamideVUN945A63DUNII-VUN945A63DN-[2-[[5-[(dimethylamino)methyl]furan-2-yl]methylsulfanyl]ethyl]-2-nitroacetamideAcetamide, N-(2-(((5-((dimethylamino)methyl)-2-furanyl)methyl)thio)ethyl)-2-nitro-Ranitidine hydrochloride specified impurity D [EP]N-[2-[[[5-[(Dimethylamino)methyl]furan-2-yl]methyl]sulfanyl]ethyl]-2-nitroacetamideRanitidine BP/EP Impurity D112251-56-6( salt)CS-0166237NS00000890
Show more names
Ranitidine EP Impurity D (Ranitidine complex nitroacetamide)N-[2-[[[5-[(Dimethylamino)methyl]-2-furanyl]methyl]thio]ethyl]-2-nitroacetamideAcetamide, N-[2-[[[5-[(dimethylamino)methyl]-2-furanyl]methyl]thio]ethyl]-2-nitro-N-[2-[[[5-[(dimethylamino)methyl]furan-2-yl]methyl]sulphanyl]ethyl]-2-nitroacetamideRanitidine Hydrochloride Impurity Ⅰ:N-(2-(((5-((dimethylamino)methyl)furan-2-yl)methyl)thio)ethyl)-2-nitroacetamideRanitidine Hydrochloride Impurity Ⅰ:N-(2-(((5-((dimethylamino)methyl)furan-2-yl)methyl)thio)ethyl)-2-nitroacetamide
Properties
Computed structural properties
- XLogP
- 0.7
- Topological polar surface area
- 117 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 8
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 322
Physicochemical properties
- Boiling point
- 476.9 · 476.9±45.0 °C(Predicted)
- Density
- 1.235 · 1.235±0.06 g/cm3(Predicted)
- pka
- 6.06 · 6.06±0.29(Predicted)
- FDA UNII
- 945 A63D · VUN945A63D
Chemistry & industry
Applications
UsesN-[2-[[[5-[(Dimethylamino)methyl]-2-furanyl]methyl]thio]ethyl]-2-nitroacetamide is an impurity compound of Ranitidine (R120000). Ranitidine is a histamine H2-receptor antagonist which inhibits gastric acid secretion. Antiulcerative.
Suppliers16 total
济南百隆化学有限公司[email protected] · [email protected]
艾吉析科技（上海）有限公司17717235263 · [email protected]
湖北瑞玛标物科技有限公司15787879035 15787875101 · [email protected]
南京望知星医药科技有限公司18569809817 · [email protected]
Sinco Pharmachem (ShenZhen) R&D Co., Ltd.+86-18603013401 · [email protected]
深圳市简一生物科技有限公司0755-84826604 · [email protected]
孟成科技（上海）有限公司400-820-6829 · [email protected]
欧利希（湖北）医药科技有限公司17316404525 17316404525 · [email protected]
Moxin Chemicals+86-17320513646 +86-17320513646 · [email protected]
杭州云易国科生物科技有限公司18457506494 · [email protected]
成都迈斯克医药科技有限公司028-84552636 18084815636 · [email protected]
sgtlifesciences pvt ltd
Related reactions
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Compound notes
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