1H-Pyrrole-2-carboxylic acid, 1-((2-aminophenyl)sulfonyl)-, ethyl ester
Basic information
- CAS
142529-01-9- Standard SMILES
CCOC(=O)c1cccn1S(=O)(=O)c1ccccc1N- InChIKey
YWQSOBQWNWDIRF-UHFFFAOYSA-N- Molecular formula
- C13H14N2O4S
- Average molar mass
- 294.33 g/mol
- Monoisotopic mass
- 294.06742811
Names & identifiers
- Preferred name
- 1H-Pyrrole-2-carboxylic acid, 1-((2-aminophenyl)sulfonyl)-, ethyl ester
- IUPAC
- ethyl 1-(2-aminophenyl)sulfonylpyrrole-2-carboxylate
- English name
- 1H-Pyrrole-2-carboxylic acid, 1-[(2-aminophenyl)sulfonyl]-, ethyl este r
- Molecular weight
- 0
Names & synonyms
142529-01-9ethyl 1-(2-aminophenyl)sulfonylpyrrole-2-carboxylate1H-Pyrrole-2-carboxylic acid, 1-((2-aminophenyl)sulfonyl)-, ethyl esterEthyl 1-((2-Aminophenyl)sulfonyl)-1H-pyrrole-2-carboxylateEthyl 1-[(2-Aminophenyl)sulfonyl]-1H-pyrrole-2-carboxylate1H-Pyrrole-2-carboxylic acid, 1-[(2-aminophenyl)sulfonyl]-, ethyl esterCHEMBL147066DTXSID401620751H-Pyrrole-2-carboxylic acid, 1-[(2-aminophenyl)sulfonyl]-, ethyl este rEthyl 1-(2-aminobenzene-1-sulfonyl)-1H-pyrrole-2-carboxylate
Database identifiers
- CAS
142529-01-9- PubChem CID
- 464840
- DTXSID
DTXSID40162075- ChEMBL
CHEMBL147066- Nikkaji
- J731.746H
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 99.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 5
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 446
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…