4-[(2-methylphenyl)methyl]-N-[(4-methylphenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide
Chemical Structure Depiction of
4-[(2-methylphenyl)methyl]-N-[(4-methylphenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide
4-[(2-methylphenyl)methyl]-N-[(4-methylphenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide
Compound characteristics
Compound ID: | C122-0013 |
Compound Name: | 4-[(2-methylphenyl)methyl]-N-[(4-methylphenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide |
Molecular Weight: | 416.54 |
Molecular Formula: | C25 H24 N2 O2 S |
Smiles: | Cc1ccc(CNC(c2ccc3c(c2)N(Cc2ccccc2C)C(CS3)=O)=O)cc1 |
Stereo: | ACHIRAL |
logP: | 5.0116 |
logD: | 5.0116 |
logSw: | -4.5423 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 40.032 |
InChI Key: | XKEZFEAPUOTXQI-UHFFFAOYSA-N |