methyl 4-(2-{[6-(2-methylpiperidin-1-yl)pyrimidin-4-yl]sulfanyl}acetamido)benzoate
Chemical Structure Depiction of
methyl 4-(2-{[6-(2-methylpiperidin-1-yl)pyrimidin-4-yl]sulfanyl}acetamido)benzoate
methyl 4-(2-{[6-(2-methylpiperidin-1-yl)pyrimidin-4-yl]sulfanyl}acetamido)benzoate
Compound characteristics
| Compound ID: | M179-4263 |
| Compound Name: | methyl 4-(2-{[6-(2-methylpiperidin-1-yl)pyrimidin-4-yl]sulfanyl}acetamido)benzoate |
| Molecular Weight: | 400.5 |
| Molecular Formula: | C20 H24 N4 O3 S |
| Smiles: | CC1CCCCN1c1cc(ncn1)SCC(Nc1ccc(cc1)C(=O)OC)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.9245 |
| logD: | 3.9241 |
| logSw: | -3.9653 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.662 |
| InChI Key: | KMZHUNUWLWXQAP-AWEZNQCLSA-N |