4-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)-1-[4-(4-fluorophenyl)piperazin-1-yl]butan-1-one
Chemical Structure Depiction of
4-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)-1-[4-(4-fluorophenyl)piperazin-1-yl]butan-1-one
4-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)-1-[4-(4-fluorophenyl)piperazin-1-yl]butan-1-one
Compound characteristics
| Compound ID: | C163-0303 |
| Compound Name: | 4-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)-1-[4-(4-fluorophenyl)piperazin-1-yl]butan-1-one |
| Molecular Weight: | 389.43 |
| Molecular Formula: | C19 H24 F N5 O3 |
| Smiles: | Cc1c(c(C)n(CCCC(N2CCN(CC2)c2ccc(cc2)F)=O)n1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 1.6221 |
| logD: | 1.6221 |
| logSw: | -1.9647 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 66.931 |
| InChI Key: | SQYGCZRLOKZVGT-UHFFFAOYSA-N |