ethyl 4-{4-[2-(4-methoxyanilino)-2-oxoethyl]-5-oxo-3-[(pyridin-3-yl)methyl]-2-sulfanylideneimidazolidin-1-yl}benzoate
Chemical Structure Depiction of
ethyl 4-{4-[2-(4-methoxyanilino)-2-oxoethyl]-5-oxo-3-[(pyridin-3-yl)methyl]-2-sulfanylideneimidazolidin-1-yl}benzoate
ethyl 4-{4-[2-(4-methoxyanilino)-2-oxoethyl]-5-oxo-3-[(pyridin-3-yl)methyl]-2-sulfanylideneimidazolidin-1-yl}benzoate
Compound characteristics
| Compound ID: | 8014-8543 |
| Compound Name: | ethyl 4-{4-[2-(4-methoxyanilino)-2-oxoethyl]-5-oxo-3-[(pyridin-3-yl)methyl]-2-sulfanylideneimidazolidin-1-yl}benzoate |
| Molecular Weight: | 518.59 |
| Molecular Formula: | C27 H26 N4 O5 S |
| Smiles: | CCOC(c1ccc(cc1)N1C(C(CC(Nc2ccc(cc2)OC)=O)N(Cc2cccnc2)C1=S)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.8186 |
| logD: | 2.8184 |
| logSw: | -3.0908 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 79.212 |
| InChI Key: | LHLLHZDXQBNKKS-HSZRJFAPSA-N |