3-{1-[(2-chloro-4-fluorophenyl)methyl]-2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl}-N-[2-(3,4-dimethoxyphenyl)ethyl]propanamide
Chemical Structure Depiction of
3-{1-[(2-chloro-4-fluorophenyl)methyl]-2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl}-N-[2-(3,4-dimethoxyphenyl)ethyl]propanamide
3-{1-[(2-chloro-4-fluorophenyl)methyl]-2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl}-N-[2-(3,4-dimethoxyphenyl)ethyl]propanamide
Compound characteristics
| Compound ID: | C260-1289 |
| Compound Name: | 3-{1-[(2-chloro-4-fluorophenyl)methyl]-2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl}-N-[2-(3,4-dimethoxyphenyl)ethyl]propanamide |
| Molecular Weight: | 539.99 |
| Molecular Formula: | C28 H27 Cl F N3 O5 |
| Smiles: | COc1ccc(CCNC(CCN2C(c3ccccc3N(Cc3ccc(cc3[Cl])F)C2=O)=O)=O)cc1OC |
| Stereo: | ACHIRAL |
| logP: | 3.5284 |
| logD: | 3.5284 |
| logSw: | -3.9768 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.819 |
| InChI Key: | YINRCZVULBYRNZ-UHFFFAOYSA-N |