1-(2,4-dimethylphenyl)-2,5-dioxopyrrolidin-3-yl N'-(4-chlorophenyl)-N-[(4-methoxyphenyl)methyl]carbamimidothioate
Chemical Structure Depiction of
1-(2,4-dimethylphenyl)-2,5-dioxopyrrolidin-3-yl N'-(4-chlorophenyl)-N-[(4-methoxyphenyl)methyl]carbamimidothioate
1-(2,4-dimethylphenyl)-2,5-dioxopyrrolidin-3-yl N'-(4-chlorophenyl)-N-[(4-methoxyphenyl)methyl]carbamimidothioate
Compound characteristics
| Compound ID: | 8009-5845 |
| Compound Name: | 1-(2,4-dimethylphenyl)-2,5-dioxopyrrolidin-3-yl N'-(4-chlorophenyl)-N-[(4-methoxyphenyl)methyl]carbamimidothioate |
| Molecular Weight: | 508.04 |
| Molecular Formula: | C27 H26 Cl N3 O3 S |
| Smiles: | Cc1ccc(c(C)c1)N1C(CC(C1=O)SC(/NCc1ccc(cc1)OC)=N/c1ccc(cc1)[Cl])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.3125 |
| logD: | 5.3102 |
| logSw: | -5.8872 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.011 |
| InChI Key: | SSRGIUKVBAKBKW-DEOSSOPVSA-N |