3-acetamido-4-[(4-chlorophenyl)sulfanyl]-N-{2-[4-(2-fluorophenyl)piperazin-1-yl]ethyl}benzamide
Chemical Structure Depiction of
3-acetamido-4-[(4-chlorophenyl)sulfanyl]-N-{2-[4-(2-fluorophenyl)piperazin-1-yl]ethyl}benzamide
3-acetamido-4-[(4-chlorophenyl)sulfanyl]-N-{2-[4-(2-fluorophenyl)piperazin-1-yl]ethyl}benzamide
Compound characteristics
| Compound ID: | K786-1965 |
| Compound Name: | 3-acetamido-4-[(4-chlorophenyl)sulfanyl]-N-{2-[4-(2-fluorophenyl)piperazin-1-yl]ethyl}benzamide |
| Molecular Weight: | 527.06 |
| Molecular Formula: | C27 H28 Cl F N4 O2 S |
| Smiles: | CC(Nc1cc(ccc1Sc1ccc(cc1)[Cl])C(NCCN1CCN(CC1)c1ccccc1F)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.577 |
| logD: | 4.5672 |
| logSw: | -4.6744 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 53.728 |
| InChI Key: | HRWROBSXXYXMPW-UHFFFAOYSA-N |