1-[(2-chloro-4-fluorophenyl)methyl]-3-[4-(3,4-dihydroisoquinolin-2(1H)-yl)-4-oxobutyl]quinazoline-2,4(1H,3H)-dione
Chemical Structure Depiction of
1-[(2-chloro-4-fluorophenyl)methyl]-3-[4-(3,4-dihydroisoquinolin-2(1H)-yl)-4-oxobutyl]quinazoline-2,4(1H,3H)-dione
1-[(2-chloro-4-fluorophenyl)methyl]-3-[4-(3,4-dihydroisoquinolin-2(1H)-yl)-4-oxobutyl]quinazoline-2,4(1H,3H)-dione
Compound characteristics
| Compound ID: | C260-2248 |
| Compound Name: | 1-[(2-chloro-4-fluorophenyl)methyl]-3-[4-(3,4-dihydroisoquinolin-2(1H)-yl)-4-oxobutyl]quinazoline-2,4(1H,3H)-dione |
| Molecular Weight: | 505.98 |
| Molecular Formula: | C28 H25 Cl F N3 O3 |
| Smiles: | C(CC(N1CCc2ccccc2C1)=O)CN1C(c2ccccc2N(Cc2ccc(cc2[Cl])F)C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.6464 |
| logD: | 4.6464 |
| logSw: | -4.941 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 47.3 |
| InChI Key: | PCWNYCGKTBCXDW-UHFFFAOYSA-N |