N-{1-[3-(2H-1,3-benzodioxol-5-yl)-1,2,4-oxadiazol-5-yl]-2-phenylethyl}-4-methylbenzamide
Chemical Structure Depiction of
N-{1-[3-(2H-1,3-benzodioxol-5-yl)-1,2,4-oxadiazol-5-yl]-2-phenylethyl}-4-methylbenzamide
N-{1-[3-(2H-1,3-benzodioxol-5-yl)-1,2,4-oxadiazol-5-yl]-2-phenylethyl}-4-methylbenzamide
Compound characteristics
Compound ID: | V029-3691 |
Compound Name: | N-{1-[3-(2H-1,3-benzodioxol-5-yl)-1,2,4-oxadiazol-5-yl]-2-phenylethyl}-4-methylbenzamide |
Molecular Weight: | 427.46 |
Molecular Formula: | C25 H21 N3 O4 |
Salt: | not_available |
Smiles: | Cc1ccc(cc1)C(NC(Cc1ccccc1)c1nc(c2ccc3c(c2)OCO3)no1)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 5.5486 |
logD: | 5.5485 |
logSw: | -5.5101 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 72.803 |
InChI Key: | QKQNEOSFBDSVHW-FQEVSTJZSA-N |