N-cyclooctyl-4-[(3-oxo-3,4-dihydro-2H-1,4-benzoxazin-2-ylidene)methyl]benzamide
Chemical Structure Depiction of
N-cyclooctyl-4-[(3-oxo-3,4-dihydro-2H-1,4-benzoxazin-2-ylidene)methyl]benzamide
N-cyclooctyl-4-[(3-oxo-3,4-dihydro-2H-1,4-benzoxazin-2-ylidene)methyl]benzamide
Compound characteristics
Compound ID: | K788-4411 |
Compound Name: | N-cyclooctyl-4-[(3-oxo-3,4-dihydro-2H-1,4-benzoxazin-2-ylidene)methyl]benzamide |
Molecular Weight: | 390.48 |
Molecular Formula: | C24 H26 N2 O3 |
Smiles: | C1CCCC(CCC1)NC(c1ccc(/C=C2/C(Nc3ccccc3O2)=O)cc1)=O |
Stereo: | ACHIRAL |
logP: | 5.2123 |
logD: | 5.2122 |
logSw: | -5.4041 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 57.277 |
InChI Key: | NAWOTHWVNLTXPO-UHFFFAOYSA-N |