Basic information
- CAS
173908-29-7- Standard SMILES
Nc1cc(Cl)ccc1S(=O)(=O)n1cccc1- InChIKey
JNLQZWXKSGAKSO-UHFFFAOYSA-N- Molecular formula
- C10H9ClN2O2S
- Average molar mass
- 256.71 g/mol
- Monoisotopic mass
- 256.0073264
Names & identifiers
- Preferred name
- 1H-Pyrrole, 1-((2-amino-4-chlorophenyl)sulfonyl)-
- IUPAC
- 5-chloro-2-pyrrol-1-ylsulfonylaniline
Names & synonyms
173908-29-71H-Pyrrole, 1-((2-amino-4-chlorophenyl)sulfonyl)-1-((4-Chloro-2-aminophenyl)sulfonyl)-1H-pyrrole1-[(4-Chloro-2-aminophenyl)sulfonyl]-1H-pyrrole1H-Pyrrole, 1-[(2-amino-4-chlorophenyl)sulfonyl]-CHEMBL151541DTXSID001697025-chloro-2-pyrrol-1-ylsulfonyl-aniline5-Chloro-2-(1H-pyrrole-1-sulfonyl)aniline
Database identifiers
- CAS
173908-29-7- PubChem CID
- 464709
- DTXSID
DTXSID00169702- ChEMBL
CHEMBL151541
Properties
Computed structural properties
- XLogP
- 2.4
- Topological polar surface area
- 73.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 335
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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