benzyl (4-oxo-4-{4-[(3-{5-[3-(trifluoromethyl)phenyl]-1,2,4-oxadiazol-3-yl}phenyl)methyl]piperazin-1-yl}butyl)carbamate
Chemical Structure Depiction of
benzyl (4-oxo-4-{4-[(3-{5-[3-(trifluoromethyl)phenyl]-1,2,4-oxadiazol-3-yl}phenyl)methyl]piperazin-1-yl}butyl)carbamate
benzyl (4-oxo-4-{4-[(3-{5-[3-(trifluoromethyl)phenyl]-1,2,4-oxadiazol-3-yl}phenyl)methyl]piperazin-1-yl}butyl)carbamate
Compound characteristics
| Compound ID: | V001-6050 |
| Compound Name: | benzyl (4-oxo-4-{4-[(3-{5-[3-(trifluoromethyl)phenyl]-1,2,4-oxadiazol-3-yl}phenyl)methyl]piperazin-1-yl}butyl)carbamate |
| Molecular Weight: | 607.63 |
| Molecular Formula: | C32 H32 F3 N5 O4 |
| Salt: | not_available |
| Smiles: | C(CC(N1CCN(CC1)Cc1cccc(c1)c1nc(c2cccc(c2)C(F)(F)F)on1)=O)CNC(=O)OCc1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 5.3973 |
| logD: | 5.3967 |
| logSw: | -5.8148 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 84.288 |
| InChI Key: | PMXZYGLFDBVFGN-UHFFFAOYSA-N |