(4-{[(1H-imidazo[4,5-c]pyridin-2-yl)sulfanyl]methyl}phenyl)[4-(4-nitrophenyl)piperazin-1-yl]methanone
Chemical Structure Depiction of
(4-{[(1H-imidazo[4,5-c]pyridin-2-yl)sulfanyl]methyl}phenyl)[4-(4-nitrophenyl)piperazin-1-yl]methanone
(4-{[(1H-imidazo[4,5-c]pyridin-2-yl)sulfanyl]methyl}phenyl)[4-(4-nitrophenyl)piperazin-1-yl]methanone
Compound characteristics
| Compound ID: | C781-0251 |
| Compound Name: | (4-{[(1H-imidazo[4,5-c]pyridin-2-yl)sulfanyl]methyl}phenyl)[4-(4-nitrophenyl)piperazin-1-yl]methanone |
| Molecular Weight: | 474.54 |
| Molecular Formula: | C24 H22 N6 O3 S |
| Smiles: | C1CN(CCN1C(c1ccc(CSc2nc3cnccc3[nH]2)cc1)=O)c1ccc(cc1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 2.8288 |
| logD: | 2.7908 |
| logSw: | -3.1896 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 80.788 |
| InChI Key: | YOSWSGGQZRKKCI-UHFFFAOYSA-N |