N~3~-(7-chloro-2-ethylquinazolin-4-yl)-N~3~-(propan-2-yl)-N-{[3-(trifluoromethyl)phenyl]methyl}-beta-alaninamide
Chemical Structure Depiction of
N~3~-(7-chloro-2-ethylquinazolin-4-yl)-N~3~-(propan-2-yl)-N-{[3-(trifluoromethyl)phenyl]methyl}-beta-alaninamide
N~3~-(7-chloro-2-ethylquinazolin-4-yl)-N~3~-(propan-2-yl)-N-{[3-(trifluoromethyl)phenyl]methyl}-beta-alaninamide
Compound characteristics
| Compound ID: | V025-4365 |
| Compound Name: | N~3~-(7-chloro-2-ethylquinazolin-4-yl)-N~3~-(propan-2-yl)-N-{[3-(trifluoromethyl)phenyl]methyl}-beta-alaninamide |
| Molecular Weight: | 478.94 |
| Molecular Formula: | C24 H26 Cl F3 N4 O |
| Salt: | not_available |
| Smiles: | CCc1nc(c2ccc(cc2n1)[Cl])N(CCC(NCc1cccc(c1)C(F)(F)F)=O)C(C)C |
| Stereo: | ACHIRAL |
| logP: | 6.2931 |
| logD: | 5.7037 |
| logSw: | -6.3362 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.657 |
| InChI Key: | CMQYGVBMIHSISX-UHFFFAOYSA-N |