2-{[4-(4-benzylpiperidin-1-yl)pyrimidin-2-yl]sulfanyl}-N-(2,3-dimethylphenyl)acetamide
Chemical Structure Depiction of
2-{[4-(4-benzylpiperidin-1-yl)pyrimidin-2-yl]sulfanyl}-N-(2,3-dimethylphenyl)acetamide
2-{[4-(4-benzylpiperidin-1-yl)pyrimidin-2-yl]sulfanyl}-N-(2,3-dimethylphenyl)acetamide
Compound characteristics
Compound ID: | M459-3509 |
Compound Name: | 2-{[4-(4-benzylpiperidin-1-yl)pyrimidin-2-yl]sulfanyl}-N-(2,3-dimethylphenyl)acetamide |
Molecular Weight: | 446.61 |
Molecular Formula: | C26 H30 N4 O S |
Smiles: | Cc1cccc(c1C)NC(CSc1nccc(n1)N1CCC(CC1)Cc1ccccc1)=O |
Stereo: | ACHIRAL |
logP: | 6.4205 |
logD: | 6.4205 |
logSw: | -5.7447 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 42.788 |
InChI Key: | MAANUFQOHFVDFR-UHFFFAOYSA-N |