[4-(4-methoxyphenyl)piperazin-1-yl](3-nitro-4-{[(pyridin-3-yl)methyl]sulfanyl}phenyl)methanone
Chemical Structure Depiction of
[4-(4-methoxyphenyl)piperazin-1-yl](3-nitro-4-{[(pyridin-3-yl)methyl]sulfanyl}phenyl)methanone
[4-(4-methoxyphenyl)piperazin-1-yl](3-nitro-4-{[(pyridin-3-yl)methyl]sulfanyl}phenyl)methanone
Compound characteristics
| Compound ID: | K672-0189 |
| Compound Name: | [4-(4-methoxyphenyl)piperazin-1-yl](3-nitro-4-{[(pyridin-3-yl)methyl]sulfanyl}phenyl)methanone |
| Molecular Weight: | 464.54 |
| Molecular Formula: | C24 H24 N4 O4 S |
| Smiles: | COc1ccc(cc1)N1CCN(CC1)C(c1ccc(c(c1)[N+]([O-])=O)SCc1cccnc1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4887 |
| logD: | 3.4444 |
| logSw: | -3.7423 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 70.018 |
| InChI Key: | IJCIBNXVEHYLPZ-UHFFFAOYSA-N |