4-({4-[(3-chlorophenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-ylidene}methyl)-N-[2-(3,4-diethoxyphenyl)ethyl]benzamide
Chemical Structure Depiction of
4-({4-[(3-chlorophenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-ylidene}methyl)-N-[2-(3,4-diethoxyphenyl)ethyl]benzamide
4-({4-[(3-chlorophenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-ylidene}methyl)-N-[2-(3,4-diethoxyphenyl)ethyl]benzamide
Compound characteristics
| Compound ID: | K788-8919 |
| Compound Name: | 4-({4-[(3-chlorophenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-ylidene}methyl)-N-[2-(3,4-diethoxyphenyl)ethyl]benzamide |
| Molecular Weight: | 613.18 |
| Molecular Formula: | C35 H33 Cl N2 O4 S |
| Smiles: | CCOc1ccc(CCNC(c2ccc(\C=C3/C(N(Cc4cccc(c4)[Cl])c4ccccc4S3)=O)cc2)=O)cc1OCC |
| Stereo: | ACHIRAL |
| logP: | 6.7391 |
| logD: | 6.7391 |
| logSw: | -6.1962 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.745 |
| InChI Key: | DASVAAIBIZEAOV-UHFFFAOYSA-N |