Basic information
- Standard SMILES
COc1cc2nc(Cl)nc(Nc3ccc(C)cc3)c2cc1OC- InChIKey
VBFXQIVTEKYBPS-UHFFFAOYSA-N- Molecular formula
- C17H16ClN3O2
- Average molar mass
- 329.8 g/mol
Names & identifiers
- Preferred name
- 2-chloro-6,7-dimethoxy-N-(4-methylphenyl)quinazolin-4-amine
- IUPAC
- 2-chloro-6,7-dimethoxy-N-(4-methylphenyl)quinazolin-4-amine
Names & synonyms
4-Anilidoquinazoline deriv. 31bBDBM4415SCHEMBL8076919VBFXQIVTEKYBPS-UHFFFAOYSA-N2-chloro-6,7-dimethoxy-N-(4-methylphenyl)quinazolin-4-amine2-chloro-6,7-dimethoxy-N-(4-methylphenyl)-4-quinazolinamine
Database identifiers
- PubChem CID
- 5328829
Properties
Computed structural properties
- XLogP
- 4.7
- Topological polar surface area
- 56.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 379
Related reactions
2 records
Compound notes
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