N-{2,5-dioxo-1-[4-(trifluoromethoxy)phenyl]pyrrolidin-3-yl}-N-heptyl-N'-[3-(trifluoromethyl)phenyl]thiourea
Chemical Structure Depiction of
N-{2,5-dioxo-1-[4-(trifluoromethoxy)phenyl]pyrrolidin-3-yl}-N-heptyl-N'-[3-(trifluoromethyl)phenyl]thiourea
N-{2,5-dioxo-1-[4-(trifluoromethoxy)phenyl]pyrrolidin-3-yl}-N-heptyl-N'-[3-(trifluoromethyl)phenyl]thiourea
Compound characteristics
| Compound ID: | 8010-4087 |
| Compound Name: | N-{2,5-dioxo-1-[4-(trifluoromethoxy)phenyl]pyrrolidin-3-yl}-N-heptyl-N'-[3-(trifluoromethyl)phenyl]thiourea |
| Molecular Weight: | 575.57 |
| Molecular Formula: | C26 H27 F6 N3 O3 S |
| Smiles: | CCCCCCCN(C1CC(N(C1=O)c1ccc(cc1)OC(F)(F)F)=O)C(Nc1cccc(c1)C(F)(F)F)=S |
| Stereo: | RACEMIC MIXTURE |
| logP: | 7.4705 |
| logD: | 7.4705 |
| logSw: | -5.7617 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 44.323 |
| InChI Key: | VXMSCTYXTSPLKN-NRFANRHFSA-N |