1-[4-(hexyloxy)phenyl]-2,5-dioxopyrrolidin-3-yl N-(2-phenylethyl)-N'-[3-(trifluoromethyl)phenyl]carbamimidothioate
Chemical Structure Depiction of
1-[4-(hexyloxy)phenyl]-2,5-dioxopyrrolidin-3-yl N-(2-phenylethyl)-N'-[3-(trifluoromethyl)phenyl]carbamimidothioate
1-[4-(hexyloxy)phenyl]-2,5-dioxopyrrolidin-3-yl N-(2-phenylethyl)-N'-[3-(trifluoromethyl)phenyl]carbamimidothioate
Compound characteristics
| Compound ID: | 8009-5848 |
| Compound Name: | 1-[4-(hexyloxy)phenyl]-2,5-dioxopyrrolidin-3-yl N-(2-phenylethyl)-N'-[3-(trifluoromethyl)phenyl]carbamimidothioate |
| Molecular Weight: | 597.7 |
| Molecular Formula: | C32 H34 F3 N3 O3 S |
| Smiles: | CCCCCCOc1ccc(cc1)N1C(CC(C1=O)SC(\NCCc1ccccc1)=N/c1cccc(c1)C(F)(F)F)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 7.2337 |
| logD: | 7.2276 |
| logSw: | -5.5825 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.027 |
| InChI Key: | ICBSAJYGLKXMPW-NDEPHWFRSA-N |