5-[1-(tert-butoxycarbonyl)piperidin-4-yl]-1-[4-(propan-2-yl)phenyl]-1H-pyrazole-4-carboxylic acid
Chemical Structure Depiction of
5-[1-(tert-butoxycarbonyl)piperidin-4-yl]-1-[4-(propan-2-yl)phenyl]-1H-pyrazole-4-carboxylic acid
5-[1-(tert-butoxycarbonyl)piperidin-4-yl]-1-[4-(propan-2-yl)phenyl]-1H-pyrazole-4-carboxylic acid
Compound characteristics
| Compound ID: | C614-5296 |
| Compound Name: | 5-[1-(tert-butoxycarbonyl)piperidin-4-yl]-1-[4-(propan-2-yl)phenyl]-1H-pyrazole-4-carboxylic acid |
| Molecular Weight: | 413.52 |
| Molecular Formula: | C23 H31 N3 O4 |
| Smiles: | CC(C)c1ccc(cc1)n1c(C2CCN(CC2)C(=O)OC(C)(C)C)c(cn1)C(O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.0663 |
| logD: | 1.7117 |
| logSw: | -5.3657 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.551 |
| InChI Key: | BYYNABNKRAUSHX-UHFFFAOYSA-N |