N~1~-[(3,4-dihydro-1H-2-benzopyran-1-yl)methyl]-N~2~-[3-(trifluoromethyl)phenyl]ethanediamide
Chemical Structure Depiction of
N~1~-[(3,4-dihydro-1H-2-benzopyran-1-yl)methyl]-N~2~-[3-(trifluoromethyl)phenyl]ethanediamide
N~1~-[(3,4-dihydro-1H-2-benzopyran-1-yl)methyl]-N~2~-[3-(trifluoromethyl)phenyl]ethanediamide
Compound characteristics
Compound ID: | D176-0045 |
Compound Name: | N~1~-[(3,4-dihydro-1H-2-benzopyran-1-yl)methyl]-N~2~-[3-(trifluoromethyl)phenyl]ethanediamide |
Molecular Weight: | 378.35 |
Molecular Formula: | C19 H17 F3 N2 O3 |
Smiles: | C1COC(CNC(C(Nc2cccc(c2)C(F)(F)F)=O)=O)c2ccccc12 |
Stereo: | RACEMIC MIXTURE |
logP: | 3.3877 |
logD: | 1.6145 |
logSw: | -3.6311 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 56.647 |
InChI Key: | WZIMDHBXEAFJEJ-INIZCTEOSA-N |