tert-butyl 4-{1-(3-chloro-2-methylphenyl)-4-[(2,5-diethoxyphenyl)carbamoyl]-1H-pyrazol-5-yl}piperidine-1-carboxylate
Chemical Structure Depiction of
tert-butyl 4-{1-(3-chloro-2-methylphenyl)-4-[(2,5-diethoxyphenyl)carbamoyl]-1H-pyrazol-5-yl}piperidine-1-carboxylate
tert-butyl 4-{1-(3-chloro-2-methylphenyl)-4-[(2,5-diethoxyphenyl)carbamoyl]-1H-pyrazol-5-yl}piperidine-1-carboxylate
Compound characteristics
| Compound ID: | E955-2259 |
| Compound Name: | tert-butyl 4-{1-(3-chloro-2-methylphenyl)-4-[(2,5-diethoxyphenyl)carbamoyl]-1H-pyrazol-5-yl}piperidine-1-carboxylate |
| Molecular Weight: | 583.13 |
| Molecular Formula: | C31 H39 Cl N4 O5 |
| Smiles: | CCOc1ccc(c(c1)NC(c1cnn(c2cccc(c2C)[Cl])c1C1CCN(CC1)C(=O)OC(C)(C)C)=O)OCC |
| Stereo: | ACHIRAL |
| logP: | 7.6721 |
| logD: | 7.6628 |
| logSw: | -6.4286 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.569 |
| InChI Key: | GOYRBDOCZLQDGK-UHFFFAOYSA-N |