tert-butyl 4-[1-(4-fluorophenyl)-4-{[3-(4-methylpiperazin-1-yl)propyl]carbamoyl}-1H-pyrazol-5-yl]piperidine-1-carboxylate
Chemical Structure Depiction of
tert-butyl 4-[1-(4-fluorophenyl)-4-{[3-(4-methylpiperazin-1-yl)propyl]carbamoyl}-1H-pyrazol-5-yl]piperidine-1-carboxylate
tert-butyl 4-[1-(4-fluorophenyl)-4-{[3-(4-methylpiperazin-1-yl)propyl]carbamoyl}-1H-pyrazol-5-yl]piperidine-1-carboxylate
Compound characteristics
| Compound ID: | E955-1835 |
| Compound Name: | tert-butyl 4-[1-(4-fluorophenyl)-4-{[3-(4-methylpiperazin-1-yl)propyl]carbamoyl}-1H-pyrazol-5-yl]piperidine-1-carboxylate |
| Molecular Weight: | 528.67 |
| Molecular Formula: | C28 H41 F N6 O3 |
| Smiles: | CC(C)(C)OC(N1CCC(CC1)c1c(cnn1c1ccc(cc1)F)C(NCCCN1CCN(C)CC1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0508 |
| logD: | 2.9005 |
| logSw: | -3.9638 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.857 |
| InChI Key: | JWKDWLIKKFBINJ-UHFFFAOYSA-N |