N-(4-bromophenyl)-2-{1-(3-chloro-4-methoxyphenyl)-3-[2-(4-methylpiperazin-1-yl)ethyl]-5-oxo-2-sulfanylideneimidazolidin-4-yl}acetamide
Chemical Structure Depiction of
N-(4-bromophenyl)-2-{1-(3-chloro-4-methoxyphenyl)-3-[2-(4-methylpiperazin-1-yl)ethyl]-5-oxo-2-sulfanylideneimidazolidin-4-yl}acetamide
N-(4-bromophenyl)-2-{1-(3-chloro-4-methoxyphenyl)-3-[2-(4-methylpiperazin-1-yl)ethyl]-5-oxo-2-sulfanylideneimidazolidin-4-yl}acetamide
Compound characteristics
| Compound ID: | C148-0251 |
| Compound Name: | N-(4-bromophenyl)-2-{1-(3-chloro-4-methoxyphenyl)-3-[2-(4-methylpiperazin-1-yl)ethyl]-5-oxo-2-sulfanylideneimidazolidin-4-yl}acetamide |
| Molecular Weight: | 594.96 |
| Molecular Formula: | C25 H29 Br Cl N5 O3 S |
| Smiles: | CN1CCN(CC1)CCN1C(CC(Nc2ccc(cc2)[Br])=O)C(N(C1=S)c1ccc(c(c1)[Cl])OC)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.9187 |
| logD: | 1.6744 |
| logSw: | -3.5055 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.465 |
| InChI Key: | BDYCAKQOEJYFIW-NRFANRHFSA-N |