5-{1-[(2-chloro-4-fluorophenyl)methyl]-2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl}-N-[2-(4-chlorophenyl)ethyl]pentanamide
Chemical Structure Depiction of
5-{1-[(2-chloro-4-fluorophenyl)methyl]-2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl}-N-[2-(4-chlorophenyl)ethyl]pentanamide
5-{1-[(2-chloro-4-fluorophenyl)methyl]-2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl}-N-[2-(4-chlorophenyl)ethyl]pentanamide
Compound characteristics
| Compound ID: | C260-1078 |
| Compound Name: | 5-{1-[(2-chloro-4-fluorophenyl)methyl]-2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl}-N-[2-(4-chlorophenyl)ethyl]pentanamide |
| Molecular Weight: | 542.44 |
| Molecular Formula: | C28 H26 Cl2 F N3 O3 |
| Smiles: | C(CCN1C(c2ccccc2N(Cc2ccc(cc2[Cl])F)C1=O)=O)CC(NCCc1ccc(cc1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 4.867 |
| logD: | 4.867 |
| logSw: | -4.9346 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.558 |
| InChI Key: | ASOBYKKPUVGNPU-UHFFFAOYSA-N |