N-(4-bromophenyl)-2-{3-[3-(4-methylpiperazin-1-yl)propyl]-1-[3-(methylsulfanyl)phenyl]-5-oxo-2-sulfanylideneimidazolidin-4-yl}acetamide
Chemical Structure Depiction of
N-(4-bromophenyl)-2-{3-[3-(4-methylpiperazin-1-yl)propyl]-1-[3-(methylsulfanyl)phenyl]-5-oxo-2-sulfanylideneimidazolidin-4-yl}acetamide
N-(4-bromophenyl)-2-{3-[3-(4-methylpiperazin-1-yl)propyl]-1-[3-(methylsulfanyl)phenyl]-5-oxo-2-sulfanylideneimidazolidin-4-yl}acetamide
Compound characteristics
| Compound ID: | C148-0542 |
| Compound Name: | N-(4-bromophenyl)-2-{3-[3-(4-methylpiperazin-1-yl)propyl]-1-[3-(methylsulfanyl)phenyl]-5-oxo-2-sulfanylideneimidazolidin-4-yl}acetamide |
| Molecular Weight: | 590.6 |
| Molecular Formula: | C26 H32 Br N5 O2 S2 |
| Smiles: | CN1CCN(CCCN2C(CC(Nc3ccc(cc3)[Br])=O)C(N(C2=S)c2cccc(c2)SC)=O)CC1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.1078 |
| logD: | 2.2932 |
| logSw: | -3.4649 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.835 |
| InChI Key: | LPJZGFWJFMBAMB-QHCPKHFHSA-N |