tert-butyl 4-[1-(2,4-difluorophenyl)-4-{[3-(4-ethylpiperazin-1-yl)propyl]carbamoyl}-1H-pyrazol-5-yl]piperidine-1-carboxylate
Chemical Structure Depiction of
tert-butyl 4-[1-(2,4-difluorophenyl)-4-{[3-(4-ethylpiperazin-1-yl)propyl]carbamoyl}-1H-pyrazol-5-yl]piperidine-1-carboxylate
tert-butyl 4-[1-(2,4-difluorophenyl)-4-{[3-(4-ethylpiperazin-1-yl)propyl]carbamoyl}-1H-pyrazol-5-yl]piperidine-1-carboxylate
Compound characteristics
| Compound ID: | E955-0844 |
| Compound Name: | tert-butyl 4-[1-(2,4-difluorophenyl)-4-{[3-(4-ethylpiperazin-1-yl)propyl]carbamoyl}-1H-pyrazol-5-yl]piperidine-1-carboxylate |
| Molecular Weight: | 560.69 |
| Molecular Formula: | C29 H42 F2 N6 O3 |
| Smiles: | CCN1CCN(CCCNC(c2cnn(c3ccc(cc3F)F)c2C2CCN(CC2)C(=O)OC(C)(C)C)=O)CC1 |
| Stereo: | ACHIRAL |
| logP: | 4.3491 |
| logD: | 3.4009 |
| logSw: | -4.043 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.616 |
| InChI Key: | RFBIGFVJDWPUBJ-UHFFFAOYSA-N |