4-({4-[(2,5-dimethylphenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-ylidene}methyl)-N-(4-phenylbutan-2-yl)benzamide
Chemical Structure Depiction of
4-({4-[(2,5-dimethylphenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-ylidene}methyl)-N-(4-phenylbutan-2-yl)benzamide
4-({4-[(2,5-dimethylphenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-ylidene}methyl)-N-(4-phenylbutan-2-yl)benzamide
Compound characteristics
| Compound ID: | C700-0050 |
| Compound Name: | 4-({4-[(2,5-dimethylphenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-ylidene}methyl)-N-(4-phenylbutan-2-yl)benzamide |
| Molecular Weight: | 546.73 |
| Molecular Formula: | C35 H34 N2 O2 S |
| Smiles: | CC(CCc1ccccc1)NC(c1ccc(/C=C2/C(N(Cc3cc(C)ccc3C)c3ccccc3S2)=O)cc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 7.946 |
| logD: | 7.946 |
| logSw: | -5.5712 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 38.924 |
| InChI Key: | NLRWSWMSUKLHSK-SANMLTNESA-N |