ethyl 1-[1-(2-cyanobenzene-1-sulfonyl)piperidin-4-yl]-5-propyl-1H-pyrazole-3-carboxylate
Chemical Structure Depiction of
ethyl 1-[1-(2-cyanobenzene-1-sulfonyl)piperidin-4-yl]-5-propyl-1H-pyrazole-3-carboxylate
ethyl 1-[1-(2-cyanobenzene-1-sulfonyl)piperidin-4-yl]-5-propyl-1H-pyrazole-3-carboxylate
Compound characteristics
| Compound ID: | V027-7147 |
| Compound Name: | ethyl 1-[1-(2-cyanobenzene-1-sulfonyl)piperidin-4-yl]-5-propyl-1H-pyrazole-3-carboxylate |
| Molecular Weight: | 430.52 |
| Molecular Formula: | C21 H26 N4 O4 S |
| Salt: | not_available |
| Smiles: | CCCc1cc(C(=O)OCC)nn1C1CCN(CC1)S(c1ccccc1C#N)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4285 |
| logD: | 3.4285 |
| logSw: | -3.735 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 82.976 |
| InChI Key: | YZQQRIMHUCCSOR-UHFFFAOYSA-N |