4-({4-[(3-chlorophenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-ylidene}methyl)-N-[(4-methylphenyl)methyl]benzamide
Chemical Structure Depiction of
4-({4-[(3-chlorophenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-ylidene}methyl)-N-[(4-methylphenyl)methyl]benzamide
4-({4-[(3-chlorophenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-ylidene}methyl)-N-[(4-methylphenyl)methyl]benzamide
Compound characteristics
Compound ID: | K788-8959 |
Compound Name: | 4-({4-[(3-chlorophenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-ylidene}methyl)-N-[(4-methylphenyl)methyl]benzamide |
Molecular Weight: | 525.07 |
Molecular Formula: | C31 H25 Cl N2 O2 S |
Smiles: | Cc1ccc(CNC(c2ccc(\C=C3/C(N(Cc4cccc(c4)[Cl])c4ccccc4S3)=O)cc2)=O)cc1 |
Stereo: | ACHIRAL |
logP: | 7.2206 |
logD: | 7.2206 |
logSw: | -6.2219 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 39.483 |
InChI Key: | KTZDRQHGFOTWEG-UHFFFAOYSA-N |