4-({4-[(2,5-dimethylphenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-ylidene}methyl)-N-[2-(4-ethoxyphenyl)ethyl]benzamide
Chemical Structure Depiction of
4-({4-[(2,5-dimethylphenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-ylidene}methyl)-N-[2-(4-ethoxyphenyl)ethyl]benzamide
4-({4-[(2,5-dimethylphenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-ylidene}methyl)-N-[2-(4-ethoxyphenyl)ethyl]benzamide
Compound characteristics
| Compound ID: | C700-0086 |
| Compound Name: | 4-({4-[(2,5-dimethylphenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-ylidene}methyl)-N-[2-(4-ethoxyphenyl)ethyl]benzamide |
| Molecular Weight: | 562.73 |
| Molecular Formula: | C35 H34 N2 O3 S |
| Smiles: | CCOc1ccc(CCNC(c2ccc(/C=C3/C(N(Cc4cc(C)ccc4C)c4ccccc4S3)=O)cc2)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 7.4903 |
| logD: | 7.4903 |
| logSw: | -5.5423 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.448 |
| InChI Key: | ZTQAKHHCIGBLQQ-UHFFFAOYSA-N |