2-{1-(3-chloro-4-methoxyphenyl)-3-[2-(4-methylpiperazin-1-yl)ethyl]-5-oxo-2-sulfanylideneimidazolidin-4-yl}-N-phenylacetamide
Chemical Structure Depiction of
2-{1-(3-chloro-4-methoxyphenyl)-3-[2-(4-methylpiperazin-1-yl)ethyl]-5-oxo-2-sulfanylideneimidazolidin-4-yl}-N-phenylacetamide
2-{1-(3-chloro-4-methoxyphenyl)-3-[2-(4-methylpiperazin-1-yl)ethyl]-5-oxo-2-sulfanylideneimidazolidin-4-yl}-N-phenylacetamide
Compound characteristics
| Compound ID: | C148-0247 |
| Compound Name: | 2-{1-(3-chloro-4-methoxyphenyl)-3-[2-(4-methylpiperazin-1-yl)ethyl]-5-oxo-2-sulfanylideneimidazolidin-4-yl}-N-phenylacetamide |
| Molecular Weight: | 516.06 |
| Molecular Formula: | C25 H30 Cl N5 O3 S |
| Smiles: | CN1CCN(CC1)CCN1C(CC(Nc2ccccc2)=O)C(N(C1=S)c1ccc(c(c1)[Cl])OC)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.8931 |
| logD: | 0.6488 |
| logSw: | -2.9407 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.465 |
| InChI Key: | YMJKRMSBQSECRR-OAQYLSRUSA-N |