2-[(5-benzoyl-3-cyano-4,6-dimethyl-1,4-dihydropyridin-2-yl)sulfanyl]acetamide
Chemical Structure Depiction of
2-[(5-benzoyl-3-cyano-4,6-dimethyl-1,4-dihydropyridin-2-yl)sulfanyl]acetamide
2-[(5-benzoyl-3-cyano-4,6-dimethyl-1,4-dihydropyridin-2-yl)sulfanyl]acetamide
Compound characteristics
Compound ID: | 8011-1510 |
Compound Name: | 2-[(5-benzoyl-3-cyano-4,6-dimethyl-1,4-dihydropyridin-2-yl)sulfanyl]acetamide |
Molecular Weight: | 327.4 |
Molecular Formula: | C17 H17 N3 O2 S |
Smiles: | CC1C(C#N)=C(NC(C)=C1C(c1ccccc1)=O)SCC(N)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 1.9376 |
logD: | 0.9745 |
logSw: | -2.5533 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 3 |
Polar surface area: | 74.229 |
InChI Key: | JYVWHRRVRHRHSH-JTQLQIEISA-N |