tert-butyl 4-{4-[(5-chloro-2,4-dimethoxyphenyl)carbamoyl]-1-(3-methylphenyl)-1H-pyrazol-5-yl}piperidine-1-carboxylate
Chemical Structure Depiction of
tert-butyl 4-{4-[(5-chloro-2,4-dimethoxyphenyl)carbamoyl]-1-(3-methylphenyl)-1H-pyrazol-5-yl}piperidine-1-carboxylate
tert-butyl 4-{4-[(5-chloro-2,4-dimethoxyphenyl)carbamoyl]-1-(3-methylphenyl)-1H-pyrazol-5-yl}piperidine-1-carboxylate
Compound characteristics
| Compound ID: | E955-0450 |
| Compound Name: | tert-butyl 4-{4-[(5-chloro-2,4-dimethoxyphenyl)carbamoyl]-1-(3-methylphenyl)-1H-pyrazol-5-yl}piperidine-1-carboxylate |
| Molecular Weight: | 555.07 |
| Molecular Formula: | C29 H35 Cl N4 O5 |
| Smiles: | Cc1cccc(c1)n1c(C2CCN(CC2)C(=O)OC(C)(C)C)c(cn1)C(Nc1cc(c(cc1OC)OC)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 6.9396 |
| logD: | 6.8003 |
| logSw: | -6.3685 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.797 |
| InChI Key: | BDAJFTOWVZLNKT-UHFFFAOYSA-N |