N~3~-propyl-N~3~-[2-(thiophen-2-yl)quinazolin-4-yl]-N-{[3-(trifluoromethyl)phenyl]methyl}-beta-alaninamide
Chemical Structure Depiction of
N~3~-propyl-N~3~-[2-(thiophen-2-yl)quinazolin-4-yl]-N-{[3-(trifluoromethyl)phenyl]methyl}-beta-alaninamide
N~3~-propyl-N~3~-[2-(thiophen-2-yl)quinazolin-4-yl]-N-{[3-(trifluoromethyl)phenyl]methyl}-beta-alaninamide
Compound characteristics
| Compound ID: | V025-1754 |
| Compound Name: | N~3~-propyl-N~3~-[2-(thiophen-2-yl)quinazolin-4-yl]-N-{[3-(trifluoromethyl)phenyl]methyl}-beta-alaninamide |
| Molecular Weight: | 498.57 |
| Molecular Formula: | C26 H25 F3 N4 O S |
| Salt: | not_available |
| Smiles: | CCCN(CCC(NCc1cccc(c1)C(F)(F)F)=O)c1c2ccccc2nc(c2cccs2)n1 |
| Stereo: | ACHIRAL |
| logP: | 6.4738 |
| logD: | 6.451 |
| logSw: | -6.0301 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.648 |
| InChI Key: | WJNMULPCNKLMGC-UHFFFAOYSA-N |