Basic information
- Standard SMILES
O=C(O)c1ccc(S(=O)(=O)NC2CC2)c(Cl)c1- InChIKey
KYZUKRGCBUXFOT-UHFFFAOYSA-N- Molecular formula
- C10H10ClNO4S
- Average molar mass
- 275.71 g/mol
- Monoisotopic mass
- 275.0019067
Names & identifiers
- Preferred name
- 3-Chloro-4-[(cyclo propylamino)sulfonyl]benzoic acid
- IUPAC
- 3-chloro-4-(cyclopropylsulfamoyl)benzoic acid
Names & synonyms
SCHEMBL3528220KYZUKRGCBUXFOT-UHFFFAOYSA-N3-chloro-4-[(cyclo propylamino)sulfonyl]benzoic acid
Database identifiers
- PubChem CID
- 68677698
Properties
Computed structural properties
- XLogP
- 1.6
- Topological polar surface area
- 91.9 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 401
Related reactions
2 records
Compound notes
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