2-{4-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl}ethyl benzoylcarbamate
Chemical Structure Depiction of
2-{4-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl}ethyl benzoylcarbamate
2-{4-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl}ethyl benzoylcarbamate
Compound characteristics
| Compound ID: | 8015-2816 |
| Compound Name: | 2-{4-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl}ethyl benzoylcarbamate |
| Molecular Weight: | 456.85 |
| Molecular Formula: | C20 H20 Cl F3 N4 O3 |
| Smiles: | C1CN(CCN1CCOC(NC(c1ccccc1)=O)=O)c1c(cc(cn1)C(F)(F)F)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 3.4311 |
| logD: | 3.0675 |
| logSw: | -3.8165 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.197 |
| InChI Key: | IKXSSVWVIAWART-UHFFFAOYSA-N |