N-(2H-1,3-benzodioxol-5-yl)-5-[1-(3-phenylpropanoyl)piperidin-4-yl]-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
N-(2H-1,3-benzodioxol-5-yl)-5-[1-(3-phenylpropanoyl)piperidin-4-yl]-1,3,4-thiadiazole-2-carboxamide
N-(2H-1,3-benzodioxol-5-yl)-5-[1-(3-phenylpropanoyl)piperidin-4-yl]-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
Compound ID: | L076-0878 |
Compound Name: | N-(2H-1,3-benzodioxol-5-yl)-5-[1-(3-phenylpropanoyl)piperidin-4-yl]-1,3,4-thiadiazole-2-carboxamide |
Molecular Weight: | 464.54 |
Molecular Formula: | C24 H24 N4 O4 S |
Smiles: | C1CN(CCC1c1nnc(C(Nc2ccc3c(c2)OCO3)=O)s1)C(CCc1ccccc1)=O |
Stereo: | ACHIRAL |
logP: | 3.5352 |
logD: | 3.5344 |
logSw: | -3.727 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 79.799 |
InChI Key: | FBSMWERIXROLEX-UHFFFAOYSA-N |