N~3~-[(furan-2-yl)methyl]-N~3~-[2-(4-methoxyphenyl)quinazolin-4-yl]-N-{[3-(trifluoromethyl)phenyl]methyl}-beta-alaninamide
Chemical Structure Depiction of
N~3~-[(furan-2-yl)methyl]-N~3~-[2-(4-methoxyphenyl)quinazolin-4-yl]-N-{[3-(trifluoromethyl)phenyl]methyl}-beta-alaninamide
N~3~-[(furan-2-yl)methyl]-N~3~-[2-(4-methoxyphenyl)quinazolin-4-yl]-N-{[3-(trifluoromethyl)phenyl]methyl}-beta-alaninamide
Compound characteristics
| Compound ID: | V024-6219 |
| Compound Name: | N~3~-[(furan-2-yl)methyl]-N~3~-[2-(4-methoxyphenyl)quinazolin-4-yl]-N-{[3-(trifluoromethyl)phenyl]methyl}-beta-alaninamide |
| Molecular Weight: | 560.58 |
| Molecular Formula: | C31 H27 F3 N4 O3 |
| Salt: | not_available |
| Smiles: | COc1ccc(cc1)c1nc(c2ccccc2n1)N(CCC(NCc1cccc(c1)C(F)(F)F)=O)Cc1ccco1 |
| Stereo: | ACHIRAL |
| logP: | 6.9975 |
| logD: | 6.5399 |
| logSw: | -6.1106 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.672 |
| InChI Key: | SARKZKMXVHLRHP-UHFFFAOYSA-N |