6-chloro-3-(2-oxo-2-{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}ethyl)-1,3-benzoxazol-2(3H)-one
Chemical Structure Depiction of
6-chloro-3-(2-oxo-2-{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}ethyl)-1,3-benzoxazol-2(3H)-one
6-chloro-3-(2-oxo-2-{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}ethyl)-1,3-benzoxazol-2(3H)-one
Compound characteristics
| Compound ID: | C082-0767 |
| Compound Name: | 6-chloro-3-(2-oxo-2-{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}ethyl)-1,3-benzoxazol-2(3H)-one |
| Molecular Weight: | 439.82 |
| Molecular Formula: | C20 H17 Cl F3 N3 O3 |
| Smiles: | C1CN(CCN1C(CN1C(=O)Oc2cc(ccc12)[Cl])=O)c1cccc(c1)C(F)(F)F |
| Stereo: | ACHIRAL |
| logP: | 3.8231 |
| logD: | 3.8231 |
| logSw: | -4.4988 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 42.72 |
| InChI Key: | VAZNUMGDNDOVTP-UHFFFAOYSA-N |