tert-butyl 4-[4-(4-benzylpiperazine-1-carbonyl)-1-(3-chloro-2-methylphenyl)-1H-pyrazol-5-yl]piperidine-1-carboxylate
Chemical Structure Depiction of
tert-butyl 4-[4-(4-benzylpiperazine-1-carbonyl)-1-(3-chloro-2-methylphenyl)-1H-pyrazol-5-yl]piperidine-1-carboxylate
tert-butyl 4-[4-(4-benzylpiperazine-1-carbonyl)-1-(3-chloro-2-methylphenyl)-1H-pyrazol-5-yl]piperidine-1-carboxylate
Compound characteristics
| Compound ID: | E955-2135 |
| Compound Name: | tert-butyl 4-[4-(4-benzylpiperazine-1-carbonyl)-1-(3-chloro-2-methylphenyl)-1H-pyrazol-5-yl]piperidine-1-carboxylate |
| Molecular Weight: | 578.16 |
| Molecular Formula: | C32 H40 Cl N5 O3 |
| Smiles: | Cc1c(cccc1[Cl])n1c(C2CCN(CC2)C(=O)OC(C)(C)C)c(cn1)C(N1CCN(CC1)Cc1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 6.5202 |
| logD: | 6.5048 |
| logSw: | -6.0323 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 55.031 |
| InChI Key: | RMNSRPSYTVHSET-UHFFFAOYSA-N |