N-[(2H-1,3-benzodioxol-5-yl)methyl]-6-bromo-3-chloro-1-benzothiophene-2-carboxamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-6-bromo-3-chloro-1-benzothiophene-2-carboxamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-6-bromo-3-chloro-1-benzothiophene-2-carboxamide
Compound characteristics
Compound ID: | Y200-3782 |
Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-6-bromo-3-chloro-1-benzothiophene-2-carboxamide |
Molecular Weight: | 424.7 |
Molecular Formula: | C17 H11 Br Cl N O3 S |
Smiles: | C(c1ccc2c(c1)OCO2)NC(c1c(c2ccc(cc2s1)[Br])[Cl])=O |
Stereo: | ACHIRAL |
logP: | 5.2599 |
logD: | 5.2599 |
logSw: | -5.8157 |
Hydrogen bond acceptors count: | 4 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 42.514 |
InChI Key: | QWBNLCOZHHIMKC-UHFFFAOYSA-N |