tert-butyl 4-{1-(3-chlorophenyl)-4-[3-methyl-4-(3-methylphenyl)piperazine-1-carbonyl]-1H-pyrazol-5-yl}piperidine-1-carboxylate
Chemical Structure Depiction of
tert-butyl 4-{1-(3-chlorophenyl)-4-[3-methyl-4-(3-methylphenyl)piperazine-1-carbonyl]-1H-pyrazol-5-yl}piperidine-1-carboxylate
tert-butyl 4-{1-(3-chlorophenyl)-4-[3-methyl-4-(3-methylphenyl)piperazine-1-carbonyl]-1H-pyrazol-5-yl}piperidine-1-carboxylate
Compound characteristics
| Compound ID: | E951-0666 |
| Compound Name: | tert-butyl 4-{1-(3-chlorophenyl)-4-[3-methyl-4-(3-methylphenyl)piperazine-1-carbonyl]-1H-pyrazol-5-yl}piperidine-1-carboxylate |
| Molecular Weight: | 578.16 |
| Molecular Formula: | C32 H40 Cl N5 O3 |
| Smiles: | CC1CN(CCN1c1cccc(C)c1)C(c1cnn(c2cccc(c2)[Cl])c1C1CCN(CC1)C(=O)OC(C)(C)C)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 7.3213 |
| logD: | 7.3213 |
| logSw: | -6.2676 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 54.27 |
| InChI Key: | MDJVUFKJMRRLPI-QHCPKHFHSA-N |