N~3~-(2-ethylquinazolin-4-yl)-N~3~-(2-phenylethyl)-N-{[3-(trifluoromethyl)phenyl]methyl}-beta-alaninamide
Chemical Structure Depiction of
N~3~-(2-ethylquinazolin-4-yl)-N~3~-(2-phenylethyl)-N-{[3-(trifluoromethyl)phenyl]methyl}-beta-alaninamide
N~3~-(2-ethylquinazolin-4-yl)-N~3~-(2-phenylethyl)-N-{[3-(trifluoromethyl)phenyl]methyl}-beta-alaninamide
Compound characteristics
| Compound ID: | V024-6238 |
| Compound Name: | N~3~-(2-ethylquinazolin-4-yl)-N~3~-(2-phenylethyl)-N-{[3-(trifluoromethyl)phenyl]methyl}-beta-alaninamide |
| Molecular Weight: | 506.57 |
| Molecular Formula: | C29 H29 F3 N4 O |
| Salt: | not_available |
| Smiles: | CCc1nc(c2ccccc2n1)N(CCC(NCc1cccc(c1)C(F)(F)F)=O)CCc1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 6.2271 |
| logD: | 5.5196 |
| logSw: | -5.9021 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.62 |
| InChI Key: | XFBNDZIZWBHVFW-UHFFFAOYSA-N |