[3,5-dimethyl-4-(4-methylpiperidine-1-sulfonyl)-1H-pyrazol-1-yl](4-nitrophenyl)methanone
Chemical Structure Depiction of
[3,5-dimethyl-4-(4-methylpiperidine-1-sulfonyl)-1H-pyrazol-1-yl](4-nitrophenyl)methanone
[3,5-dimethyl-4-(4-methylpiperidine-1-sulfonyl)-1H-pyrazol-1-yl](4-nitrophenyl)methanone
Compound characteristics
| Compound ID: | G680-0304 |
| Compound Name: | [3,5-dimethyl-4-(4-methylpiperidine-1-sulfonyl)-1H-pyrazol-1-yl](4-nitrophenyl)methanone |
| Molecular Weight: | 406.46 |
| Molecular Formula: | C18 H22 N4 O5 S |
| Smiles: | CC1CCN(CC1)S(c1c(C)nn(C(c2ccc(cc2)[N+]([O-])=O)=O)c1C)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.0473 |
| logD: | 2.0473 |
| logSw: | -2.4423 |
| Hydrogen bond acceptors count: | 12 |
| Polar surface area: | 92.945 |
| InChI Key: | OBBBYCSQSKYAHK-UHFFFAOYSA-N |