[2,2-dimethyl-3-(2-methylprop-1-en-1-yl)cyclopropyl]{4-[3-(3,5-dimethyl-1H-pyrazol-1-yl)-4-nitrophenyl]piperazin-1-yl}methanone
Chemical Structure Depiction of
[2,2-dimethyl-3-(2-methylprop-1-en-1-yl)cyclopropyl]{4-[3-(3,5-dimethyl-1H-pyrazol-1-yl)-4-nitrophenyl]piperazin-1-yl}methanone
[2,2-dimethyl-3-(2-methylprop-1-en-1-yl)cyclopropyl]{4-[3-(3,5-dimethyl-1H-pyrazol-1-yl)-4-nitrophenyl]piperazin-1-yl}methanone
Compound characteristics
Compound ID: | 8016-9102 |
Compound Name: | [2,2-dimethyl-3-(2-methylprop-1-en-1-yl)cyclopropyl]{4-[3-(3,5-dimethyl-1H-pyrazol-1-yl)-4-nitrophenyl]piperazin-1-yl}methanone |
Molecular Weight: | 451.57 |
Molecular Formula: | C25 H33 N5 O3 |
Smiles: | CC(C)=CC1C(C(N2CCN(CC2)c2ccc(c(c2)n2c(C)cc(C)n2)[N+]([O-])=O)=O)C1(C)C |
Stereo: | MIXTURE OF STEREOISOMERS |
logP: | 4.6304 |
logD: | 4.6304 |
logSw: | -4.5381 |
Hydrogen bond acceptors count: | 7 |
Polar surface area: | 67.322 |
InChI Key: | RUGWGHHBGJIRFD-UHFFFAOYSA-N |