N-[4-(2-oxo-3-{[4-(propan-2-yl)phenyl]methyl}-1,3-diazinan-1-yl)phenyl]-4-(trifluoromethyl)benzamide
Chemical Structure Depiction of
N-[4-(2-oxo-3-{[4-(propan-2-yl)phenyl]methyl}-1,3-diazinan-1-yl)phenyl]-4-(trifluoromethyl)benzamide
N-[4-(2-oxo-3-{[4-(propan-2-yl)phenyl]methyl}-1,3-diazinan-1-yl)phenyl]-4-(trifluoromethyl)benzamide
Compound characteristics
| Compound ID: | V030-0590 |
| Compound Name: | N-[4-(2-oxo-3-{[4-(propan-2-yl)phenyl]methyl}-1,3-diazinan-1-yl)phenyl]-4-(trifluoromethyl)benzamide |
| Molecular Weight: | 495.54 |
| Molecular Formula: | C28 H28 F3 N3 O2 |
| Smiles: | CC(C)c1ccc(CN2CCCN(C2=O)c2ccc(cc2)NC(c2ccc(cc2)C(F)(F)F)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 6.4589 |
| logD: | 6.4588 |
| logSw: | -5.7001 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 42.888 |
| InChI Key: | GDDXBDFTMRYEAU-UHFFFAOYSA-N |