N-[(4-ethoxy-3-methoxyphenyl)methyl]-2-{4-[(4-methylphenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-ylidene}acetamide
Chemical Structure Depiction of
N-[(4-ethoxy-3-methoxyphenyl)methyl]-2-{4-[(4-methylphenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-ylidene}acetamide
N-[(4-ethoxy-3-methoxyphenyl)methyl]-2-{4-[(4-methylphenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-ylidene}acetamide
Compound characteristics
| Compound ID: | K788-1183 |
| Compound Name: | N-[(4-ethoxy-3-methoxyphenyl)methyl]-2-{4-[(4-methylphenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-ylidene}acetamide |
| Molecular Weight: | 488.61 |
| Molecular Formula: | C28 H28 N2 O4 S |
| Smiles: | CCOc1ccc(CNC(/C=C2/C(N(Cc3ccc(C)cc3)c3ccccc3S2)=O)=O)cc1OC |
| Stereo: | ACHIRAL |
| logP: | 4.8427 |
| logD: | 4.8427 |
| logSw: | -4.4795 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.382 |
| InChI Key: | ISZRMBMCCZAABM-UHFFFAOYSA-N |