tert-butyl 4-[1-(2-chlorophenyl)-4-{[3-(4-methylpiperidin-1-yl)propyl]carbamoyl}-1H-pyrazol-5-yl]piperidine-1-carboxylate
Chemical Structure Depiction of
tert-butyl 4-[1-(2-chlorophenyl)-4-{[3-(4-methylpiperidin-1-yl)propyl]carbamoyl}-1H-pyrazol-5-yl]piperidine-1-carboxylate
tert-butyl 4-[1-(2-chlorophenyl)-4-{[3-(4-methylpiperidin-1-yl)propyl]carbamoyl}-1H-pyrazol-5-yl]piperidine-1-carboxylate
Compound characteristics
| Compound ID: | E955-1550 |
| Compound Name: | tert-butyl 4-[1-(2-chlorophenyl)-4-{[3-(4-methylpiperidin-1-yl)propyl]carbamoyl}-1H-pyrazol-5-yl]piperidine-1-carboxylate |
| Molecular Weight: | 544.14 |
| Molecular Formula: | C29 H42 Cl N5 O3 |
| Smiles: | CC1CCN(CCCNC(c2cnn(c3ccccc3[Cl])c2C2CCN(CC2)C(=O)OC(C)(C)C)=O)CC1 |
| Stereo: | ACHIRAL |
| logP: | 6.0224 |
| logD: | 3.5621 |
| logSw: | -5.8712 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.079 |
| InChI Key: | DBSRONIJQGGWBB-UHFFFAOYSA-N |