N-benzyl-2-benzylidene-4-[(3-methylphenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide
Chemical Structure Depiction of
N-benzyl-2-benzylidene-4-[(3-methylphenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide
N-benzyl-2-benzylidene-4-[(3-methylphenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide
Compound characteristics
Compound ID: | K788-9731 |
Compound Name: | N-benzyl-2-benzylidene-4-[(3-methylphenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide |
Molecular Weight: | 490.62 |
Molecular Formula: | C31 H26 N2 O2 S |
Smiles: | Cc1cccc(CN2C(/C(=C/c3ccccc3)Sc3ccc(cc23)C(NCc2ccccc2)=O)=O)c1 |
Stereo: | ACHIRAL |
logP: | 6.8902 |
logD: | 6.8902 |
logSw: | -5.6003 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 39.483 |
InChI Key: | HEHUUBUCRZXVKD-UHFFFAOYSA-N |