2-(3-{3-[4-(4-fluorophenyl)piperazin-1-yl]propyl}-1-[(furan-2-yl)methyl]-5-oxo-2-sulfanylideneimidazolidin-4-yl)-N-(4-propoxyphenyl)acetamide
Chemical Structure Depiction of
2-(3-{3-[4-(4-fluorophenyl)piperazin-1-yl]propyl}-1-[(furan-2-yl)methyl]-5-oxo-2-sulfanylideneimidazolidin-4-yl)-N-(4-propoxyphenyl)acetamide
2-(3-{3-[4-(4-fluorophenyl)piperazin-1-yl]propyl}-1-[(furan-2-yl)methyl]-5-oxo-2-sulfanylideneimidazolidin-4-yl)-N-(4-propoxyphenyl)acetamide
Compound characteristics
| Compound ID: | C089-0110 |
| Compound Name: | 2-(3-{3-[4-(4-fluorophenyl)piperazin-1-yl]propyl}-1-[(furan-2-yl)methyl]-5-oxo-2-sulfanylideneimidazolidin-4-yl)-N-(4-propoxyphenyl)acetamide |
| Molecular Weight: | 607.75 |
| Molecular Formula: | C32 H38 F N5 O4 S |
| Smiles: | CCCOc1ccc(cc1)NC(CC1C(N(Cc2ccco2)C(N1CCCN1CCN(CC1)c1ccc(cc1)F)=S)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.502 |
| logD: | 4.2752 |
| logSw: | -3.9443 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.396 |
| InChI Key: | KHCBJMZQUWFFIL-GDLZYMKVSA-N |