Basic information
- Standard SMILES
O=C(c1ccncc1)c1cc(Cl)ccc1NS(=O)(=O)c1ccc(-c2cnco2)cc1- InChIKey
RTKDFNSPSDEHEI-UHFFFAOYSA-N- Molecular formula
- C21H14ClN3O4S
- Average molar mass
- 439.9 g/mol
Names & identifiers
- Preferred name
- N-[4-Chloro-2-(pyridine-4-carbonyl)-phenyl]-4-oxazol-5-yl-benzenesulfonamide
- IUPAC
- N-[4-chloro-2-(pyridine-4-carbonyl)phenyl]-4-(1,3-oxazol-5-yl)benzenesulfonamide
Names & synonyms
SCHEMBL343002CHEMBL3715272RTKDFNSPSDEHEI-UHFFFAOYSA-NN-[4-Chloro-2-(pyridine-4-carbonyl)-phenyl]-4-oxazol-5-yl-benzenesulfonamideN-[4-Chloro-2-(pyridine4-carbonyl)-phenyl]-4-oxazol-5-yl-benzenesulfonamide
Database identifiers
- PubChem CID
- 10003340
- ChEMBL
CHEMBL3715272
Properties
Computed structural properties
- XLogP
- 4
- Topological polar surface area
- 111 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 6
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 687
Related reactions
5 records
Compound notes
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