1-(4-methoxyphenyl)-2,5-dioxopyrrolidin-3-yl N'-(4-chlorophenyl)-N-ethylcarbamimidothioate
Chemical Structure Depiction of
1-(4-methoxyphenyl)-2,5-dioxopyrrolidin-3-yl N'-(4-chlorophenyl)-N-ethylcarbamimidothioate
1-(4-methoxyphenyl)-2,5-dioxopyrrolidin-3-yl N'-(4-chlorophenyl)-N-ethylcarbamimidothioate
Compound characteristics
Compound ID: | 3456-0971 |
Compound Name: | 1-(4-methoxyphenyl)-2,5-dioxopyrrolidin-3-yl N'-(4-chlorophenyl)-N-ethylcarbamimidothioate |
Molecular Weight: | 417.91 |
Molecular Formula: | C20 H20 Cl N3 O3 S |
Smiles: | CCN\C(=N/c1ccc(cc1)[Cl])SC1CC(N(C1=O)c1ccc(cc1)OC)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 3.123 |
logD: | 3.1211 |
logSw: | -3.5171 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 55.209 |
InChI Key: | CJBULKDJBWMULE-KRWDZBQOSA-N |