3-chloro-N-[(2,4-dimethoxyphenyl)methyl]-6-(trifluoromethyl)-1-benzothiophene-2-carboxamide
Chemical Structure Depiction of
3-chloro-N-[(2,4-dimethoxyphenyl)methyl]-6-(trifluoromethyl)-1-benzothiophene-2-carboxamide
3-chloro-N-[(2,4-dimethoxyphenyl)methyl]-6-(trifluoromethyl)-1-benzothiophene-2-carboxamide
Compound characteristics
Compound ID: | V007-2964 |
Compound Name: | 3-chloro-N-[(2,4-dimethoxyphenyl)methyl]-6-(trifluoromethyl)-1-benzothiophene-2-carboxamide |
Molecular Weight: | 429.84 |
Molecular Formula: | C19 H15 Cl F3 N O3 S |
Smiles: | COc1ccc(CNC(c2c(c3ccc(cc3s2)C(F)(F)F)[Cl])=O)c(c1)OC |
Stereo: | ACHIRAL |
logP: | 5.6973 |
logD: | 5.6973 |
logSw: | -6.2202 |
Hydrogen bond acceptors count: | 4 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 40.573 |
InChI Key: | GYKYCRPSSCOKNZ-UHFFFAOYSA-N |