Basic information
- Standard SMILES
Cc1ccc(-c2nc(CCN3C(=O)c4ccccc4C3=O)cn2C(c2nc3cc(Cl)ccc3c(=O)n2Cc2ccccc2)C(C)C)cc1- InChIKey
QCTWIJVKKPOVNB-UHFFFAOYSA-N- Molecular formula
- C39H34ClN5O3
- Average molar mass
- 656.2 g/mol
Names & identifiers
- Preferred name
- 2-(2-{1-[1-(3-Benzyl-7-chloro-4-oxo-3,4-dihydro-quinazolin-2-yl)-2-methyl-propyl]-2-p-tolyl-1H-imidazol-4-yl}-ethyl)-isoindole-1,3-dione
- IUPAC
- 2-[2-[1-[1-(3-benzyl-7-chloro-4-oxoquinazolin-2-yl)-2-methylpropyl]-2-(4-methylphenyl)imidazol-4-yl]ethyl]isoindole-1,3-dione
Names & synonyms
SCHEMBL4520233QCTWIJVKKPOVNB-UHFFFAOYSA-N2-(2-{1-[1-(3-Benzyl-7-chloro-4-oxo-3,4-dihydro-quinazolin-2-yl)-2-methyl-propyl]-2-p-tolyl-1H-imidazol-4-yl }-ethyl)-isoindole-1,3-dione2-(2-{1-[1-(3-Benzyl-7-chloro-4-oxo-3,4-dihydro-quinazolin-2-yl)-2-methyl-propyl]-2-p-tolyl-1H-imidazol-4-yl}-ethyl)-isoindole-1,3-dione
Database identifiers
- PubChem CID
- 21096989
Properties
Computed structural properties
- XLogP
- 7.3
- Topological polar surface area
- 87.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 9
- Heavy atoms
- 48
- Formal charge
- 0
- Complexity
- 1,190
Related reactions
7 records
Compound notes
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