ethyl 1-[1-(3-chloro-1-benzothiophene-2-carbonyl)piperidin-4-yl]-5-propyl-1H-pyrazole-3-carboxylate
Chemical Structure Depiction of
ethyl 1-[1-(3-chloro-1-benzothiophene-2-carbonyl)piperidin-4-yl]-5-propyl-1H-pyrazole-3-carboxylate
ethyl 1-[1-(3-chloro-1-benzothiophene-2-carbonyl)piperidin-4-yl]-5-propyl-1H-pyrazole-3-carboxylate
Compound characteristics
| Compound ID: | V015-5745 |
| Compound Name: | ethyl 1-[1-(3-chloro-1-benzothiophene-2-carbonyl)piperidin-4-yl]-5-propyl-1H-pyrazole-3-carboxylate |
| Molecular Weight: | 459.99 |
| Molecular Formula: | C23 H26 Cl N3 O3 S |
| Salt: | not_available |
| Smiles: | CCCc1cc(C(=O)OCC)nn1C1CCN(CC1)C(c1c(c2ccccc2s1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 5.3821 |
| logD: | 5.3821 |
| logSw: | -5.9673 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 51.604 |
| InChI Key: | ZXMLAAPALRPHSM-UHFFFAOYSA-N |