[4-(4-methoxyphenyl)piperazin-1-yl](4-{[(4-methylphenyl)methyl]sulfanyl}-3-nitrophenyl)methanone
Chemical Structure Depiction of
[4-(4-methoxyphenyl)piperazin-1-yl](4-{[(4-methylphenyl)methyl]sulfanyl}-3-nitrophenyl)methanone
[4-(4-methoxyphenyl)piperazin-1-yl](4-{[(4-methylphenyl)methyl]sulfanyl}-3-nitrophenyl)methanone
Compound characteristics
| Compound ID: | K672-0167 |
| Compound Name: | [4-(4-methoxyphenyl)piperazin-1-yl](4-{[(4-methylphenyl)methyl]sulfanyl}-3-nitrophenyl)methanone |
| Molecular Weight: | 477.58 |
| Molecular Formula: | C26 H27 N3 O4 S |
| Smiles: | Cc1ccc(CSc2ccc(cc2[N+]([O-])=O)C(N2CCN(CC2)c2ccc(cc2)OC)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.9241 |
| logD: | 4.9241 |
| logSw: | -4.7441 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 60.5 |
| InChI Key: | OIXOFMOGDGLUHU-UHFFFAOYSA-N |