2-{1-(3-chloro-4-methoxyphenyl)-3-[3-(4-methylpiperazin-1-yl)propyl]-5-oxo-2-sulfanylideneimidazolidin-4-yl}-N-(4-methoxyphenyl)acetamide
Chemical Structure Depiction of
2-{1-(3-chloro-4-methoxyphenyl)-3-[3-(4-methylpiperazin-1-yl)propyl]-5-oxo-2-sulfanylideneimidazolidin-4-yl}-N-(4-methoxyphenyl)acetamide
2-{1-(3-chloro-4-methoxyphenyl)-3-[3-(4-methylpiperazin-1-yl)propyl]-5-oxo-2-sulfanylideneimidazolidin-4-yl}-N-(4-methoxyphenyl)acetamide
Compound characteristics
| Compound ID: | C089-0034 |
| Compound Name: | 2-{1-(3-chloro-4-methoxyphenyl)-3-[3-(4-methylpiperazin-1-yl)propyl]-5-oxo-2-sulfanylideneimidazolidin-4-yl}-N-(4-methoxyphenyl)acetamide |
| Molecular Weight: | 560.12 |
| Molecular Formula: | C27 H34 Cl N5 O4 S |
| Smiles: | CN1CCN(CCCN2C(CC(Nc3ccc(cc3)OC)=O)C(N(C2=S)c2ccc(c(c2)[Cl])OC)=O)CC1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.2033 |
| logD: | 1.3887 |
| logSw: | -3.3214 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.009 |
| InChI Key: | QVAWIFWMYMRALN-HSZRJFAPSA-N |