3-cyano-N-[4-(2-oxo-3-{[3-(trifluoromethyl)phenyl]methyl}-1,3-diazinan-1-yl)phenyl]benzamide
Chemical Structure Depiction of
3-cyano-N-[4-(2-oxo-3-{[3-(trifluoromethyl)phenyl]methyl}-1,3-diazinan-1-yl)phenyl]benzamide
3-cyano-N-[4-(2-oxo-3-{[3-(trifluoromethyl)phenyl]methyl}-1,3-diazinan-1-yl)phenyl]benzamide
Compound characteristics
| Compound ID: | V030-5698 |
| Compound Name: | 3-cyano-N-[4-(2-oxo-3-{[3-(trifluoromethyl)phenyl]methyl}-1,3-diazinan-1-yl)phenyl]benzamide |
| Molecular Weight: | 478.47 |
| Molecular Formula: | C26 H21 F3 N4 O2 |
| Smiles: | C1CN(Cc2cccc(c2)C(F)(F)F)C(N(C1)c1ccc(cc1)NC(c1cccc(C#N)c1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.626 |
| logD: | 4.6245 |
| logSw: | -4.5307 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.944 |
| InChI Key: | OIOQELPVPCRLEA-UHFFFAOYSA-N |