tert-butyl 4-[1-(3-chloro-2-methylphenyl)-4-{[(2-chlorophenyl)methyl]carbamoyl}-1H-pyrazol-5-yl]piperidine-1-carboxylate
Chemical Structure Depiction of
tert-butyl 4-[1-(3-chloro-2-methylphenyl)-4-{[(2-chlorophenyl)methyl]carbamoyl}-1H-pyrazol-5-yl]piperidine-1-carboxylate
tert-butyl 4-[1-(3-chloro-2-methylphenyl)-4-{[(2-chlorophenyl)methyl]carbamoyl}-1H-pyrazol-5-yl]piperidine-1-carboxylate
Compound characteristics
| Compound ID: | E955-2152 |
| Compound Name: | tert-butyl 4-[1-(3-chloro-2-methylphenyl)-4-{[(2-chlorophenyl)methyl]carbamoyl}-1H-pyrazol-5-yl]piperidine-1-carboxylate |
| Molecular Weight: | 543.49 |
| Molecular Formula: | C28 H32 Cl2 N4 O3 |
| Smiles: | Cc1c(cccc1[Cl])n1c(C2CCN(CC2)C(=O)OC(C)(C)C)c(cn1)C(NCc1ccccc1[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 7.7271 |
| logD: | 7.7271 |
| logSw: | -6.2599 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.256 |
| InChI Key: | DGNQJUNVMVOQSZ-UHFFFAOYSA-N |