N~3~-(7-chloro-2-ethylquinazolin-4-yl)-N~3~-(2-methoxyethyl)-N-{[3-(trifluoromethyl)phenyl]methyl}-beta-alaninamide
Chemical Structure Depiction of
N~3~-(7-chloro-2-ethylquinazolin-4-yl)-N~3~-(2-methoxyethyl)-N-{[3-(trifluoromethyl)phenyl]methyl}-beta-alaninamide
N~3~-(7-chloro-2-ethylquinazolin-4-yl)-N~3~-(2-methoxyethyl)-N-{[3-(trifluoromethyl)phenyl]methyl}-beta-alaninamide
Compound characteristics
| Compound ID: | V011-9877 |
| Compound Name: | N~3~-(7-chloro-2-ethylquinazolin-4-yl)-N~3~-(2-methoxyethyl)-N-{[3-(trifluoromethyl)phenyl]methyl}-beta-alaninamide |
| Molecular Weight: | 494.94 |
| Molecular Formula: | C24 H26 Cl F3 N4 O2 |
| Salt: | not_available |
| Smiles: | CCc1nc(c2ccc(cc2n1)[Cl])N(CCC(NCc1cccc(c1)C(F)(F)F)=O)CCOC |
| Stereo: | ACHIRAL |
| logP: | 5.4237 |
| logD: | 4.7162 |
| logSw: | -6.0642 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.234 |
| InChI Key: | BNBIWZXXKZTEPJ-UHFFFAOYSA-N |