3-[1-(2-methylbenzene-1-sulfonyl)piperidin-4-yl]-N-[(4-methylphenyl)methyl]propanamide
Chemical Structure Depiction of
3-[1-(2-methylbenzene-1-sulfonyl)piperidin-4-yl]-N-[(4-methylphenyl)methyl]propanamide
3-[1-(2-methylbenzene-1-sulfonyl)piperidin-4-yl]-N-[(4-methylphenyl)methyl]propanamide
Compound characteristics
Compound ID: | M306-0581 |
Compound Name: | 3-[1-(2-methylbenzene-1-sulfonyl)piperidin-4-yl]-N-[(4-methylphenyl)methyl]propanamide |
Molecular Weight: | 414.57 |
Molecular Formula: | C23 H30 N2 O3 S |
Smiles: | Cc1ccc(CNC(CCC2CCN(CC2)S(c2ccccc2C)(=O)=O)=O)cc1 |
Stereo: | ACHIRAL |
logP: | 4.099 |
logD: | 4.099 |
logSw: | -4.1288 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 56.149 |
InChI Key: | DIYXQPYJWDMIKP-UHFFFAOYSA-N |