tert-butyl 4-[1-(4-methoxyphenyl)-4-{[2-(4-methylpiperazin-1-yl)ethyl]carbamoyl}-1H-pyrazol-5-yl]piperidine-1-carboxylate
Chemical Structure Depiction of
tert-butyl 4-[1-(4-methoxyphenyl)-4-{[2-(4-methylpiperazin-1-yl)ethyl]carbamoyl}-1H-pyrazol-5-yl]piperidine-1-carboxylate
tert-butyl 4-[1-(4-methoxyphenyl)-4-{[2-(4-methylpiperazin-1-yl)ethyl]carbamoyl}-1H-pyrazol-5-yl]piperidine-1-carboxylate
Compound characteristics
| Compound ID: | E955-1131 |
| Compound Name: | tert-butyl 4-[1-(4-methoxyphenyl)-4-{[2-(4-methylpiperazin-1-yl)ethyl]carbamoyl}-1H-pyrazol-5-yl]piperidine-1-carboxylate |
| Molecular Weight: | 526.68 |
| Molecular Formula: | C28 H42 N6 O4 |
| Smiles: | CC(C)(C)OC(N1CCC(CC1)c1c(cnn1c1ccc(cc1)OC)C(NCCN1CCN(C)CC1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8809 |
| logD: | 3.2134 |
| logSw: | -3.8186 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.401 |
| InChI Key: | NJMAREMIYUCFHM-UHFFFAOYSA-N |