Basic information
- Standard SMILES
O=S(=O)(Cl)c1ccc(Nc2ncnc3cc(Cl)ccc23)cc1- InChIKey
MGJSTICWVFACAE-UHFFFAOYSA-N- Molecular formula
- C14H9Cl2N3O2S
- Average molar mass
- 354.2 g/mol
Names & identifiers
- Preferred name
- 4-[(7-Chloroquinazolin-4-yl)amino]benzenesulfonyl chloride
- IUPAC
- 4-[(7-chloroquinazolin-4-yl)amino]benzenesulfonyl chloride
Names & synonyms
SCHEMBL10496011
Database identifiers
- PubChem CID
- 13537201
Properties
Computed structural properties
- XLogP
- 4.1
- Topological polar surface area
- 80.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 477
Related reactions
3 records
Compound notes
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