Basic information
- Standard SMILES
CS(=O)(=O)c1ccc(C(=O)Nc2ccc(Cl)c(-c3cnc4ccccc4n3)c2)cc1- InChIKey
PTJHLAKWABYBME-UHFFFAOYSA-N- Molecular formula
- C22H16ClN3O3S
- Average molar mass
- 437.9 g/mol
- Monoisotopic mass
- 437.0600902
Names & identifiers
- Preferred name
- n-(4-Chloro-3-quinoxalin-2-yl-phenyl)-4-methanesulfonyl-benzamide
- IUPAC
- N-(4-chloro-3-quinoxalin-2-ylphenyl)-4-methylsulfonylbenzamide
Names & synonyms
SCHEMBL4905510PTJHLAKWABYBME-UHFFFAOYSA-Nn-(4-chloro-3-quinoxalin-2-yl-phenyl)-4-methanesulfonyl-benzamide
Database identifiers
- PubChem CID
- 59826481
Properties
Computed structural properties
- XLogP
- 3.6
- Topological polar surface area
- 97.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 705
Related reactions
1 records
Compound notes
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