Basic information
- CAS
34104-46-6- Standard SMILES
O=C(NCCOC(=O)c1cccnc1)c1cccnc1- InChIKey
XHQVBXRLUVDWRQ-UHFFFAOYSA-N- Molecular formula
- C14H13N3O3
- Average molar mass
- 271.27 g/mol
- Monoisotopic mass
- 271.09569129
Overview
structure given in first source
Names & identifiers
- Preferred name
- SG 103
- IUPAC
- 2-(pyridine-3-carbonylamino)ethyl pyridine-3-carboxylate
- English name
- SG 103
- Molecular formula
- C14H13N3O3
- Molecular weight
- 271.27
Names & synonyms
34104-46-6SG 103SG-103DTXSID501876983-Pyridinecarboxylic acid, 2-((3-pyridinylcarbonyl)amino)ethyl esterRefChem:182661DTXCID101101892-(pyridine-3-carbonylamino)ethyl pyridine-3-carboxylate2-(Nicotinamido)ethyl nicotinateBRN 04192522-(pyridine-3-carbonylamino)ethylpyridine-3-carboxylateSCHEMBL29447171
Show more names
Nicorandil Impurity 39Nicorandil Impurity 28Nicorandil Impurity 21 DiHClPyridine-3-carboxylic acid 2-(3-pyridinylcarbonylamino)ethyl ester3-Pyridinecarboxylic acid, 2-[(3-pyridinylcarbonyl)amino]ethyl ester
NICOTINIC ACID, ESTER with N-(2-HYDROXYETHYL)NICOTINAMIDEAKOS0051668802-(Pyridine-3-carboxamido)ethyl pyridine-3-carboxylate
Database identifiers
- CAS
34104-46-6- PubChem CID
- 36677
- DTXSID
Properties
Computed structural properties
- XLogP
- 0.6
- Topological polar surface area
- 81.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 6
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 336
Physicochemical properties
- Boiling point
- 531 · 531.0±35.0 °C(Predicted)
- Density
- 1.261 · 1.261±0.06 g/cm3(Predicted)
- pka
- 12.65 · 12.65±0.46(Predicted)
Chemistry & industry
Suppliers15 total
济南百隆化学有限公司[email protected] · [email protected]
广州佳途科技股份有限公司81960175-877 18933936954 · [email protected]
Sinco Pharmachem (ShenZhen) R&D Co., Ltd.+86-18603013401 · [email protected]
上海柯维化学技术有限公司021-64609169 18901607656 · [email protected]
山东沃德森生物科技有限公司0531-88723173 18596073690 · [email protected]
深圳振强药物研发有限公司0755-66853366 13670046396 · [email protected]
石家庄耀博医药科技有限公司15633056635 · [email protected]
湖北扬信医药科技有限公司15374522761 · [email protected]
湖北瑞诺医药科技有限公司13165688766 · [email protected]
北京爱科姆科技有限公司17710328343 · [email protected]
深圳博泰尔生物技术有限公司13316949107 13316968096 · [email protected]
深圳瑞恺德生物科技有限公司0755-61348847 17820674378 · [email protected]
上海语锌医药科技有限公司15921286451; 15921286451 · [email protected]
上海择睿生物科技有限公司021-54580889 18321124657 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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