N-[(2H-1,3-benzodioxol-5-yl)methyl]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
Compound characteristics
Compound ID: | C760-0354 |
Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide |
Molecular Weight: | 315.39 |
Molecular Formula: | C17 H17 N O3 S |
Smiles: | C1CCc2c(C1)c(cs2)C(NCc1ccc2c(c1)OCO2)=O |
Stereo: | ACHIRAL |
logP: | 3.9062 |
logD: | 3.9062 |
logSw: | -4.0841 |
Hydrogen bond acceptors count: | 4 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 42.706 |
InChI Key: | FAISMNCXDUKECH-UHFFFAOYSA-N |