4-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)-1-[4-(2-methoxyphenyl)piperazin-1-yl]butan-1-one
Chemical Structure Depiction of
4-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)-1-[4-(2-methoxyphenyl)piperazin-1-yl]butan-1-one
4-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)-1-[4-(2-methoxyphenyl)piperazin-1-yl]butan-1-one
Compound characteristics
| Compound ID: | C163-0292 |
| Compound Name: | 4-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)-1-[4-(2-methoxyphenyl)piperazin-1-yl]butan-1-one |
| Molecular Weight: | 401.46 |
| Molecular Formula: | C20 H27 N5 O4 |
| Smiles: | Cc1c(c(C)n(CCCC(N2CCN(CC2)c2ccccc2OC)=O)n1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 1.4722 |
| logD: | 1.4719 |
| logSw: | -1.881 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 74.261 |
| InChI Key: | AOHNHUAYRIHWGT-UHFFFAOYSA-N |