tert-butyl 4-{1-(3-chloro-2-methylphenyl)-4-[4-(4-chlorophenyl)piperazine-1-carbonyl]-1H-pyrazol-5-yl}piperidine-1-carboxylate
Chemical Structure Depiction of
tert-butyl 4-{1-(3-chloro-2-methylphenyl)-4-[4-(4-chlorophenyl)piperazine-1-carbonyl]-1H-pyrazol-5-yl}piperidine-1-carboxylate
tert-butyl 4-{1-(3-chloro-2-methylphenyl)-4-[4-(4-chlorophenyl)piperazine-1-carbonyl]-1H-pyrazol-5-yl}piperidine-1-carboxylate
Compound characteristics
| Compound ID: | E955-2155 |
| Compound Name: | tert-butyl 4-{1-(3-chloro-2-methylphenyl)-4-[4-(4-chlorophenyl)piperazine-1-carbonyl]-1H-pyrazol-5-yl}piperidine-1-carboxylate |
| Molecular Weight: | 598.57 |
| Molecular Formula: | C31 H37 Cl2 N5 O3 |
| Smiles: | Cc1c(cccc1[Cl])n1c(C2CCN(CC2)C(=O)OC(C)(C)C)c(cn1)C(N1CCN(CC1)c1ccc(cc1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 7.5555 |
| logD: | 7.5554 |
| logSw: | -6.2819 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 54.751 |
| InChI Key: | BOMLNUVEENAUOU-UHFFFAOYSA-N |