N-(4-bromo-2-methylphenyl)-4H-thieno[3,2-c][1]benzopyran-2-carboxamide
Chemical Structure Depiction of
N-(4-bromo-2-methylphenyl)-4H-thieno[3,2-c][1]benzopyran-2-carboxamide
N-(4-bromo-2-methylphenyl)-4H-thieno[3,2-c][1]benzopyran-2-carboxamide
Compound characteristics
Compound ID: | C712-1058 |
Compound Name: | N-(4-bromo-2-methylphenyl)-4H-thieno[3,2-c][1]benzopyran-2-carboxamide |
Molecular Weight: | 400.29 |
Molecular Formula: | C19 H14 Br N O2 S |
Smiles: | Cc1cc(ccc1NC(c1cc2COc3ccccc3c2s1)=O)[Br] |
Stereo: | ACHIRAL |
logP: | 5.386 |
logD: | 5.3858 |
logSw: | -5.4067 |
Hydrogen bond acceptors count: | 3 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 31.749 |
InChI Key: | XJHNYZGUHSSKBT-UHFFFAOYSA-N |