4-[(2-methylphenyl)methyl]-3-oxo-N-(4-phenylbutan-2-yl)-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide
Chemical Structure Depiction of
4-[(2-methylphenyl)methyl]-3-oxo-N-(4-phenylbutan-2-yl)-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide
4-[(2-methylphenyl)methyl]-3-oxo-N-(4-phenylbutan-2-yl)-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide
Compound characteristics
Compound ID: | C122-0029 |
Compound Name: | 4-[(2-methylphenyl)methyl]-3-oxo-N-(4-phenylbutan-2-yl)-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide |
Molecular Weight: | 444.6 |
Molecular Formula: | C27 H28 N2 O2 S |
Smiles: | CC(CCc1ccccc1)NC(c1ccc2c(c1)N(Cc1ccccc1C)C(CS2)=O)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 5.3464 |
logD: | 5.3464 |
logSw: | -5.2138 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 39.474 |
InChI Key: | OYDNZNYNKPQNRE-FQEVSTJZSA-N |