4-{1-[(2-cyanophenyl)methyl]-2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl}-N-[(4-fluorophenyl)methyl]butanamide
Chemical Structure Depiction of
4-{1-[(2-cyanophenyl)methyl]-2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl}-N-[(4-fluorophenyl)methyl]butanamide
4-{1-[(2-cyanophenyl)methyl]-2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl}-N-[(4-fluorophenyl)methyl]butanamide
Compound characteristics
| Compound ID: | C260-0773 |
| Compound Name: | 4-{1-[(2-cyanophenyl)methyl]-2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl}-N-[(4-fluorophenyl)methyl]butanamide |
| Molecular Weight: | 470.5 |
| Molecular Formula: | C27 H23 F N4 O3 |
| Smiles: | C(CC(NCc1ccc(cc1)F)=O)CN1C(c2ccccc2N(Cc2ccccc2C#N)C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9529 |
| logD: | 2.9529 |
| logSw: | -3.5398 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.773 |
| InChI Key: | LXJPAVSLMYXJFH-UHFFFAOYSA-N |