N~3~-[2-(3-bromophenyl)quinazolin-4-yl]-N~3~-propyl-N-{[3-(trifluoromethyl)phenyl]methyl}-beta-alaninamide
Chemical Structure Depiction of
N~3~-[2-(3-bromophenyl)quinazolin-4-yl]-N~3~-propyl-N-{[3-(trifluoromethyl)phenyl]methyl}-beta-alaninamide
N~3~-[2-(3-bromophenyl)quinazolin-4-yl]-N~3~-propyl-N-{[3-(trifluoromethyl)phenyl]methyl}-beta-alaninamide
Compound characteristics
| Compound ID: | V004-8552 |
| Compound Name: | N~3~-[2-(3-bromophenyl)quinazolin-4-yl]-N~3~-propyl-N-{[3-(trifluoromethyl)phenyl]methyl}-beta-alaninamide |
| Molecular Weight: | 571.44 |
| Molecular Formula: | C28 H26 Br F3 N4 O |
| Salt: | not_available |
| Smiles: | CCCN(CCC(NCc1cccc(c1)C(F)(F)F)=O)c1c2ccccc2nc(c2cccc(c2)[Br])n1 |
| Stereo: | ACHIRAL |
| logP: | 7.9311 |
| logD: | 7.3467 |
| logSw: | -6.0606 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 45.63 |
| InChI Key: | AXBZDXMGDJWSOD-UHFFFAOYSA-N |