1-(2-methoxyphenyl)-2,5-dioxopyrrolidin-3-yl N-benzyl-N'-[4-(trifluoromethoxy)phenyl]carbamimidothioate
Chemical Structure Depiction of
1-(2-methoxyphenyl)-2,5-dioxopyrrolidin-3-yl N-benzyl-N'-[4-(trifluoromethoxy)phenyl]carbamimidothioate
1-(2-methoxyphenyl)-2,5-dioxopyrrolidin-3-yl N-benzyl-N'-[4-(trifluoromethoxy)phenyl]carbamimidothioate
Compound characteristics
| Compound ID: | 8010-4089 |
| Compound Name: | 1-(2-methoxyphenyl)-2,5-dioxopyrrolidin-3-yl N-benzyl-N'-[4-(trifluoromethoxy)phenyl]carbamimidothioate |
| Molecular Weight: | 529.54 |
| Molecular Formula: | C26 H22 F3 N3 O4 S |
| Smiles: | COc1ccccc1N1C(CC(C1=O)SC(/NCc1ccccc1)=N/c1ccc(cc1)OC(F)(F)F)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.6427 |
| logD: | 4.6258 |
| logSw: | -4.4447 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.034 |
| InChI Key: | IYWNCVROLBTBMM-QFIPXVFZSA-N |