Basic information
- CAS
173550-69-1- Standard SMILES
NS(=O)(=O)c1ccc(NC(=O)Nc2ccc(Cl)cc2)cc1- InChIKey
HACQCGHVZICZSC-UHFFFAOYSA-N- Molecular formula
- C13H12ClN3O3S
- Average molar mass
- 325.77 g/mol
- Monoisotopic mass
- 325.0287901
Overview
1-(4-chlorophenyl)-3-(4-sulfamoylphenyl)urea is a sulfonamide.
Names & identifiers
- Preferred name
- AI-204/31750036
- IUPAC
- 1-(4-chlorophenyl)-3-(4-sulfamoylphenyl)urea
Names & synonyms
173550-69-1DTXSID10352643AI-204/31750036RefChem:317845DTXCID803037081-(4-chlorophenyl)-3-(4-sulfamoylphenyl)ureaMLS0007043354-{[(4-chloroanilino)carbonyl]amino}benzenesulfonamideSMR000230984Benzenesulfonamide, 4-[[[(4-chlorophenyl)amino]carbonyl]amino]-Oprea1_331972Oprea1_659254
Show more names
SCHEMBL671549cid_730672CHEMBL1446150BDBM56662CHEBI:112239HACQCGHVZICZSC-UHFFFAOYSA-NHMS3754O07STK019184
Database identifiers
- CAS
173550-69-1- PubChem CID
- 730672
- DTXSID
DTXSID10352643- ChEMBL
CHEMBL1446150- ChEBI
CHEBI:112239
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 110 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 450
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…