1-(2-fluorophenyl)-2,5-dioxopyrrolidin-3-yl N'-(2H-1,3-benzodioxol-5-yl)-N-ethylcarbamimidothioate
Chemical Structure Depiction of
1-(2-fluorophenyl)-2,5-dioxopyrrolidin-3-yl N'-(2H-1,3-benzodioxol-5-yl)-N-ethylcarbamimidothioate
1-(2-fluorophenyl)-2,5-dioxopyrrolidin-3-yl N'-(2H-1,3-benzodioxol-5-yl)-N-ethylcarbamimidothioate
Compound characteristics
| Compound ID: | 8009-4193 |
| Compound Name: | 1-(2-fluorophenyl)-2,5-dioxopyrrolidin-3-yl N'-(2H-1,3-benzodioxol-5-yl)-N-ethylcarbamimidothioate |
| Molecular Weight: | 415.44 |
| Molecular Formula: | C20 H18 F N3 O4 S |
| Smiles: | CCN\C(=N/c1ccc2c(c1)OCO2)SC1CC(N(C1=O)c1ccccc1F)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.7241 |
| logD: | 2.717 |
| logSw: | -3.3593 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.48 |
| InChI Key: | CUKKVGBNYCHXHR-KRWDZBQOSA-N |