2-{3-[3-(4-benzylpiperazin-1-yl)propyl]-1-(3-methoxyphenyl)-5-oxo-2-sulfanylideneimidazolidin-4-yl}-N-(4-chlorophenyl)acetamide
Chemical Structure Depiction of
2-{3-[3-(4-benzylpiperazin-1-yl)propyl]-1-(3-methoxyphenyl)-5-oxo-2-sulfanylideneimidazolidin-4-yl}-N-(4-chlorophenyl)acetamide
2-{3-[3-(4-benzylpiperazin-1-yl)propyl]-1-(3-methoxyphenyl)-5-oxo-2-sulfanylideneimidazolidin-4-yl}-N-(4-chlorophenyl)acetamide
Compound characteristics
| Compound ID: | C148-0531 |
| Compound Name: | 2-{3-[3-(4-benzylpiperazin-1-yl)propyl]-1-(3-methoxyphenyl)-5-oxo-2-sulfanylideneimidazolidin-4-yl}-N-(4-chlorophenyl)acetamide |
| Molecular Weight: | 606.19 |
| Molecular Formula: | C32 H36 Cl N5 O3 S |
| Smiles: | COc1cccc(c1)N1C(C(CC(Nc2ccc(cc2)[Cl])=O)N(CCCN2CCN(CC2)Cc2ccccc2)C1=S)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.1025 |
| logD: | 3.7324 |
| logSw: | -4.4699 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.442 |
| InChI Key: | YRTUCDMFJYGNJW-LJAQVGFWSA-N |