ethyl 4-{2-[1-(4-methoxyphenyl)-5-oxo-3-{[4-(2-oxopyrrolidin-1-yl)phenyl]methyl}-2-sulfanylideneimidazolidin-4-yl]acetamido}benzoate
Chemical Structure Depiction of
ethyl 4-{2-[1-(4-methoxyphenyl)-5-oxo-3-{[4-(2-oxopyrrolidin-1-yl)phenyl]methyl}-2-sulfanylideneimidazolidin-4-yl]acetamido}benzoate
ethyl 4-{2-[1-(4-methoxyphenyl)-5-oxo-3-{[4-(2-oxopyrrolidin-1-yl)phenyl]methyl}-2-sulfanylideneimidazolidin-4-yl]acetamido}benzoate
Compound characteristics
| Compound ID: | 8014-7624 |
| Compound Name: | ethyl 4-{2-[1-(4-methoxyphenyl)-5-oxo-3-{[4-(2-oxopyrrolidin-1-yl)phenyl]methyl}-2-sulfanylideneimidazolidin-4-yl]acetamido}benzoate |
| Molecular Weight: | 600.69 |
| Molecular Formula: | C32 H32 N4 O6 S |
| Smiles: | CCOC(c1ccc(cc1)NC(CC1C(N(C(N1Cc1ccc(cc1)N1CCCC1=O)=S)c1ccc(cc1)OC)=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.9186 |
| logD: | 3.9182 |
| logSw: | -4.0032 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 86.511 |
| InChI Key: | UDWXUWMJGPUJPH-HHHXNRCGSA-N |