N-[3-(4-benzylpiperazin-1-yl)propyl]-2-{[2-(4-chlorophenyl)-5-methyl-1,3-oxazol-4-yl]methanesulfinyl}acetamide
Chemical Structure Depiction of
N-[3-(4-benzylpiperazin-1-yl)propyl]-2-{[2-(4-chlorophenyl)-5-methyl-1,3-oxazol-4-yl]methanesulfinyl}acetamide
N-[3-(4-benzylpiperazin-1-yl)propyl]-2-{[2-(4-chlorophenyl)-5-methyl-1,3-oxazol-4-yl]methanesulfinyl}acetamide
Compound characteristics
| Compound ID: | K788-8773 |
| Compound Name: | N-[3-(4-benzylpiperazin-1-yl)propyl]-2-{[2-(4-chlorophenyl)-5-methyl-1,3-oxazol-4-yl]methanesulfinyl}acetamide |
| Molecular Weight: | 529.1 |
| Molecular Formula: | C27 H33 Cl N4 O3 S |
| Smiles: | Cc1c(CS(CC(NCCCN2CCN(CC2)Cc2ccccc2)=O)=O)nc(c2ccc(cc2)[Cl])o1 |
| Stereo: | ACHIRAL |
| logP: | 2.7698 |
| logD: | 1.9501 |
| logSw: | -3.6197 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.969 |
| InChI Key: | FPVCXFZCTMFBJA-UHFFFAOYSA-N |