tert-butyl 4-[1-(4-nitrophenyl)-4-{[2-(thiophen-3-yl)ethyl]carbamoyl}-1H-pyrazol-5-yl]piperidine-1-carboxylate
Chemical Structure Depiction of
tert-butyl 4-[1-(4-nitrophenyl)-4-{[2-(thiophen-3-yl)ethyl]carbamoyl}-1H-pyrazol-5-yl]piperidine-1-carboxylate
tert-butyl 4-[1-(4-nitrophenyl)-4-{[2-(thiophen-3-yl)ethyl]carbamoyl}-1H-pyrazol-5-yl]piperidine-1-carboxylate
Compound characteristics
| Compound ID: | E955-1277 |
| Compound Name: | tert-butyl 4-[1-(4-nitrophenyl)-4-{[2-(thiophen-3-yl)ethyl]carbamoyl}-1H-pyrazol-5-yl]piperidine-1-carboxylate |
| Molecular Weight: | 525.63 |
| Molecular Formula: | C26 H31 N5 O5 S |
| Smiles: | CC(C)(C)OC(N1CCC(CC1)c1c(cnn1c1ccc(cc1)[N+]([O-])=O)C(NCCc1ccsc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.4197 |
| logD: | 5.4197 |
| logSw: | -5.153 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 93.798 |
| InChI Key: | JBPSBYARBMDCKZ-UHFFFAOYSA-N |