N-(3-nitrophenyl)-2-(pyridin-2-ylsulfanyl)acetamide
Basic information
- CAS
271775-43-0- Standard SMILES
O=C(CSc1ccccn1)Nc1cccc([N+](=O)[O-])c1- InChIKey
YKHAKWGKUUIOPT-UHFFFAOYSA-N- Molecular formula
- C13H11N3O3S
- Average molar mass
- 289.31 g/mol
- Monoisotopic mass
- 289.05211239
Names & identifiers
- Preferred name
- N-(3-nitrophenyl)-2-(pyridin-2-ylsulfanyl)acetamide
- IUPAC
- N-(3-nitrophenyl)-2-pyridin-2-ylsulfanylacetamide
- English name
- N-(3-NITROPHENYL)-2-(2-PYRIDYLTHIO)ETHANAMIDE
- Molecular formula
- C13H11N3O3S
- Molecular weight
- 289.31
Names & synonyms
271775-43-0N-(3-nitrophenyl)-2-(pyridin-2-ylsulfanyl)acetamideN-(3-nitrophenyl)-2-pyridin-2-ylsulfanylacetamideN-(3-nitrophenyl)-2-(pyridin-2-ylthio)acetamideN-(3-nitrophenyl)-2-(2-pyridinylsulfanyl)acetamideN-{3-nitrophenyl}-2-(2-pyridinylsulfanyl)acetamideMFCD00098785MLS001006944N-(3-NITROPHENYL)-2-(2-PYRIDYLTHIO)ETHANAMIDECHEMBL1463802DTXSID501320032HMS2708B14
Show more names
Acetamide, N-(3-nitrophenyl)-2-(2-pyridinylthio)-
WKA77543STK226556AKOS001013506JS-0002SMR000349824ST013828CS-0333396N-(3-nitrophenyl)-2-(2-pyridylthio)acetamide
Database identifiers
- CAS
271775-43-0- PubChem CID
- 721827
- DTXSID
DTXSID501320032- ChEMBL
CHEMBL1463802- EC Number
- 150-055-0
Properties
Computed structural properties
- XLogP
- 2.4
- Topological polar surface area
- 113 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 348
Experimental & physicochemical properties
Solubility38 [ug/mL] (The mean of the results at pH 7.4)
Suppliers
Loading…
Open inquiries
Loading…
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…