N-benzyl-N-[(pyridin-3-yl)methyl]-N'-[3-(trifluoromethyl)phenyl]thiourea
Chemical Structure Depiction of
N-benzyl-N-[(pyridin-3-yl)methyl]-N'-[3-(trifluoromethyl)phenyl]thiourea
N-benzyl-N-[(pyridin-3-yl)methyl]-N'-[3-(trifluoromethyl)phenyl]thiourea
Compound characteristics
| Compound ID: | C087-1215 |
| Compound Name: | N-benzyl-N-[(pyridin-3-yl)methyl]-N'-[3-(trifluoromethyl)phenyl]thiourea |
| Molecular Weight: | 401.45 |
| Molecular Formula: | C21 H18 F3 N3 S |
| Smiles: | C(c1ccccc1)N(Cc1cccnc1)C(Nc1cccc(c1)C(F)(F)F)=S |
| Stereo: | ACHIRAL |
| logP: | 4.8333 |
| logD: | 4.8327 |
| logSw: | -4.6682 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 19.9457 |
| InChI Key: | PEQUCZZYIWMPTA-UHFFFAOYSA-N |