Basic information
- Standard SMILES
COC(=O)c1ccc2c(=O)[nH]c(Cc3ccc(Cl)c(Cl)c3)nc2c1- InChIKey
CGBDZCNXHIULJG-UHFFFAOYSA-N- Molecular formula
- C17H12Cl2N2O3
- Average molar mass
- 363.2 g/mol
Names & identifiers
- Preferred name
- Methyl 2-(3,4-dichlorobenzyl)-4-oxo-3,4-dihydroquinazoline-7-carboxylate
- IUPAC
- methyl 2-[(3,4-dichlorophenyl)methyl]-4-oxo-3H-quinazoline-7-carboxylate
Names & synonyms
SCHEMBL402452CGBDZCNXHIULJG-UHFFFAOYSA-NMethyl 2-(3,4-dichlorobenzyl)-4-oxo-3,4-dihydroquinazoline-7-carboxylate
Database identifiers
- PubChem CID
- 136330126
Properties
Computed structural properties
- XLogP
- 3.4
- Topological polar surface area
- 67.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 540
Related reactions
3 records
Compound notes
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