N-[(4-methylphenyl)methyl]-4-(pyrrolidin-1-yl)-3-{[2-(trifluoromethyl)phenyl]carbamamido}benzamide
Chemical Structure Depiction of
N-[(4-methylphenyl)methyl]-4-(pyrrolidin-1-yl)-3-{[2-(trifluoromethyl)phenyl]carbamamido}benzamide
N-[(4-methylphenyl)methyl]-4-(pyrrolidin-1-yl)-3-{[2-(trifluoromethyl)phenyl]carbamamido}benzamide
Compound characteristics
| Compound ID: | G545-0323 |
| Compound Name: | N-[(4-methylphenyl)methyl]-4-(pyrrolidin-1-yl)-3-{[2-(trifluoromethyl)phenyl]carbamamido}benzamide |
| Molecular Weight: | 496.53 |
| Molecular Formula: | C27 H27 F3 N4 O2 |
| Smiles: | Cc1ccc(CNC(c2ccc(c(c2)NC(Nc2ccccc2C(F)(F)F)=O)N2CCCC2)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 5.9317 |
| logD: | 5.9302 |
| logSw: | -5.469 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 59.077 |
| InChI Key: | QJGVGOVQRHMIQE-UHFFFAOYSA-N |