4-{1-[(2-chloro-4-fluorophenyl)methyl]-2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl}-N-[(4-methylphenyl)methyl]butanamide
Chemical Structure Depiction of
4-{1-[(2-chloro-4-fluorophenyl)methyl]-2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl}-N-[(4-methylphenyl)methyl]butanamide
4-{1-[(2-chloro-4-fluorophenyl)methyl]-2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl}-N-[(4-methylphenyl)methyl]butanamide
Compound characteristics
| Compound ID: | C260-2713 |
| Compound Name: | 4-{1-[(2-chloro-4-fluorophenyl)methyl]-2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl}-N-[(4-methylphenyl)methyl]butanamide |
| Molecular Weight: | 493.96 |
| Molecular Formula: | C27 H25 Cl F N3 O3 |
| Smiles: | Cc1ccc(CNC(CCCN2C(c3ccccc3N(Cc3ccc(cc3[Cl])F)C2=O)=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.4068 |
| logD: | 4.4068 |
| logSw: | -4.5304 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.717 |
| InChI Key: | YHRHGTHUHMNMHZ-UHFFFAOYSA-N |