1-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-5-(4-methoxyphenyl)-N-[(pyridin-4-yl)methyl]-1H-pyrazole-3-carboxamide
Chemical Structure Depiction of
1-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-5-(4-methoxyphenyl)-N-[(pyridin-4-yl)methyl]-1H-pyrazole-3-carboxamide
1-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-5-(4-methoxyphenyl)-N-[(pyridin-4-yl)methyl]-1H-pyrazole-3-carboxamide
Compound characteristics
| Compound ID: | Y044-3158 |
| Compound Name: | 1-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-5-(4-methoxyphenyl)-N-[(pyridin-4-yl)methyl]-1H-pyrazole-3-carboxamide |
| Molecular Weight: | 426.49 |
| Molecular Formula: | C21 H22 N4 O4 S |
| Smiles: | COc1ccc(cc1)c1cc(C(NCc2ccncc2)=O)nn1C1CCS(C1)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.1333 |
| logD: | 1.1299 |
| logSw: | -2.0591 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 82.717 |
| InChI Key: | NSENBAJYJZSTQM-QGZVFWFLSA-N |