tert-butyl 4-{1-(3-chloro-2-methylphenyl)-4-[4-(2,5-dimethylphenyl)piperazine-1-carbonyl]-1H-pyrazol-5-yl}piperidine-1-carboxylate
Chemical Structure Depiction of
tert-butyl 4-{1-(3-chloro-2-methylphenyl)-4-[4-(2,5-dimethylphenyl)piperazine-1-carbonyl]-1H-pyrazol-5-yl}piperidine-1-carboxylate
tert-butyl 4-{1-(3-chloro-2-methylphenyl)-4-[4-(2,5-dimethylphenyl)piperazine-1-carbonyl]-1H-pyrazol-5-yl}piperidine-1-carboxylate
Compound characteristics
Compound ID: | E955-2179 |
Compound Name: | tert-butyl 4-{1-(3-chloro-2-methylphenyl)-4-[4-(2,5-dimethylphenyl)piperazine-1-carbonyl]-1H-pyrazol-5-yl}piperidine-1-carboxylate |
Molecular Weight: | 592.18 |
Molecular Formula: | C33 H42 Cl N5 O3 |
Smiles: | Cc1ccc(C)c(c1)N1CCN(CC1)C(c1cnn(c2cccc(c2C)[Cl])c1C1CCN(CC1)C(=O)OC(C)(C)C)=O |
Stereo: | ACHIRAL |
logP: | 7.9971 |
logD: | 7.9971 |
logSw: | -6.408 |
Hydrogen bond acceptors count: | 6 |
Polar surface area: | 54.45 |
InChI Key: | HGVRYTTXWHPXNI-UHFFFAOYSA-N |