ethyl 5-(4-{4-[2-(methylsulfanyl)pyridine-3-carbonyl]piperazin-1-yl}phenyl)-1-(pyridin-2-yl)-1H-pyrazole-3-carboxylate
Chemical Structure Depiction of
ethyl 5-(4-{4-[2-(methylsulfanyl)pyridine-3-carbonyl]piperazin-1-yl}phenyl)-1-(pyridin-2-yl)-1H-pyrazole-3-carboxylate
ethyl 5-(4-{4-[2-(methylsulfanyl)pyridine-3-carbonyl]piperazin-1-yl}phenyl)-1-(pyridin-2-yl)-1H-pyrazole-3-carboxylate
Compound characteristics
| Compound ID: | V008-7545 |
| Compound Name: | ethyl 5-(4-{4-[2-(methylsulfanyl)pyridine-3-carbonyl]piperazin-1-yl}phenyl)-1-(pyridin-2-yl)-1H-pyrazole-3-carboxylate |
| Molecular Weight: | 528.63 |
| Molecular Formula: | C28 H28 N6 O3 S |
| Salt: | not_available |
| Smiles: | CCOC(c1cc(c2ccc(cc2)N2CCN(CC2)C(c2cccnc2SC)=O)n(c2ccccn2)n1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1932 |
| logD: | 4.1932 |
| logSw: | -4.114 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 71.414 |
| InChI Key: | JPCXSFLSFVOQOF-UHFFFAOYSA-N |