1-(4-methoxyphenyl)-2,5-dioxopyrrolidin-3-yl N-ethyl-N'-(3-fluorophenyl)carbamimidothioate
Chemical Structure Depiction of
1-(4-methoxyphenyl)-2,5-dioxopyrrolidin-3-yl N-ethyl-N'-(3-fluorophenyl)carbamimidothioate
1-(4-methoxyphenyl)-2,5-dioxopyrrolidin-3-yl N-ethyl-N'-(3-fluorophenyl)carbamimidothioate
Compound characteristics
| Compound ID: | 3456-0970 |
| Compound Name: | 1-(4-methoxyphenyl)-2,5-dioxopyrrolidin-3-yl N-ethyl-N'-(3-fluorophenyl)carbamimidothioate |
| Molecular Weight: | 401.46 |
| Molecular Formula: | C20 H20 F N3 O3 S |
| Smiles: | CCN\C(=N/c1cccc(c1)F)SC1CC(N(C1=O)c1ccc(cc1)OC)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.7837 |
| logD: | 2.783 |
| logSw: | -3.3197 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.209 |
| InChI Key: | WHKHIRTWRXMCAU-KRWDZBQOSA-N |