1-(4-bromophenyl)-2,5-dioxopyrrolidin-3-yl N'-(4-ethoxyphenyl)-N-methylcarbamimidothioate
Chemical Structure Depiction of
1-(4-bromophenyl)-2,5-dioxopyrrolidin-3-yl N'-(4-ethoxyphenyl)-N-methylcarbamimidothioate
1-(4-bromophenyl)-2,5-dioxopyrrolidin-3-yl N'-(4-ethoxyphenyl)-N-methylcarbamimidothioate
Compound characteristics
| Compound ID: | Y508-1848 |
| Compound Name: | 1-(4-bromophenyl)-2,5-dioxopyrrolidin-3-yl N'-(4-ethoxyphenyl)-N-methylcarbamimidothioate |
| Molecular Weight: | 462.36 |
| Molecular Formula: | C20 H20 Br N3 O3 S |
| Smiles: | CCOc1ccc(cc1)/N=C(\NC)SC1CC(N(C1=O)c1ccc(cc1)[Br])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.3916 |
| logD: | 3.3725 |
| logSw: | -3.5548 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.313 |
| InChI Key: | SGGAHOJIBFPFDP-QGZVFWFLSA-N |