N-(1-benzylpiperidin-4-yl)-1-methyl-1,4-dihydro[1]benzothiopyrano[4,3-c]pyrazole-3-carboxamide
Chemical Structure Depiction of
N-(1-benzylpiperidin-4-yl)-1-methyl-1,4-dihydro[1]benzothiopyrano[4,3-c]pyrazole-3-carboxamide
N-(1-benzylpiperidin-4-yl)-1-methyl-1,4-dihydro[1]benzothiopyrano[4,3-c]pyrazole-3-carboxamide
Compound characteristics
Compound ID: | E146-1586 |
Compound Name: | N-(1-benzylpiperidin-4-yl)-1-methyl-1,4-dihydro[1]benzothiopyrano[4,3-c]pyrazole-3-carboxamide |
Molecular Weight: | 418.56 |
Molecular Formula: | C24 H26 N4 O S |
Smiles: | Cn1c2c3ccccc3SCc2c(C(NC2CCN(CC2)Cc2ccccc2)=O)n1 |
Stereo: | ACHIRAL |
logP: | 3.1604 |
logD: | 1.7152 |
logSw: | -3.6666 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 42.241 |
InChI Key: | BNAWLWVUWUFKPI-UHFFFAOYSA-N |