N~3~-benzyl-N~3~-[2-(furan-2-yl)quinazolin-4-yl]-N-{[3-(trifluoromethyl)phenyl]methyl}-beta-alaninamide
Chemical Structure Depiction of
N~3~-benzyl-N~3~-[2-(furan-2-yl)quinazolin-4-yl]-N-{[3-(trifluoromethyl)phenyl]methyl}-beta-alaninamide
N~3~-benzyl-N~3~-[2-(furan-2-yl)quinazolin-4-yl]-N-{[3-(trifluoromethyl)phenyl]methyl}-beta-alaninamide
Compound characteristics
| Compound ID: | V024-6186 |
| Compound Name: | N~3~-benzyl-N~3~-[2-(furan-2-yl)quinazolin-4-yl]-N-{[3-(trifluoromethyl)phenyl]methyl}-beta-alaninamide |
| Molecular Weight: | 530.55 |
| Molecular Formula: | C30 H25 F3 N4 O2 |
| Salt: | not_available |
| Smiles: | C(CN(Cc1ccccc1)c1c2ccccc2nc(c2ccco2)n1)C(NCc1cccc(c1)C(F)(F)F)=O |
| Stereo: | ACHIRAL |
| logP: | 6.1036 |
| logD: | 6.0929 |
| logSw: | -6.3982 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.958 |
| InChI Key: | VVYYNQXUKBLXGB-UHFFFAOYSA-N |