Basic information
- Standard SMILES
CN(C)C=Cc1nc2ccccc2c(=O)n1-c1ccccc1Cl- InChIKey
BMLKLFXXMOOVJX-UHFFFAOYSA-N- Molecular formula
- C18H16ClN3O
- Average molar mass
- 325.8 g/mol
Names & identifiers
- Preferred name
- 3-(2-Chloro-phenyl)-2-(2-dimethylamino-vinyl)-3,4-dihydro-quinazolin-4-one
- IUPAC
- 3-(2-chlorophenyl)-2-[2-(dimethylamino)ethenyl]quinazolin-4-one
Names & synonyms
SCHEMBL6217688BMLKLFXXMOOVJX-UHFFFAOYSA-N3-(2-chloro-phenyl)-2-(2-dimethylamino-vinyl)-3,4-dihydro-quinazolin-4-one
Database identifiers
- PubChem CID
- 53689769
Properties
Computed structural properties
- XLogP
- 3.4
- Topological polar surface area
- 35.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 502
Related reactions
4 records
Compound notes
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