4-({4-[(3-chlorophenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-ylidene}methyl)-N-[2-(3,4-dimethoxyphenyl)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-dimethoxyphenyl)ethyl]benzamide
4-({4-[(3-chlorophenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-ylidene}methyl)-N-[2-(3,4-dimethoxyphenyl)ethyl]benzamide
Compound characteristics
| Compound ID: | K788-8968 |
| Compound Name: | 4-({4-[(3-chlorophenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-ylidene}methyl)-N-[2-(3,4-dimethoxyphenyl)ethyl]benzamide |
| Molecular Weight: | 585.12 |
| Molecular Formula: | C33 H29 Cl N2 O4 S |
| Smiles: | COc1ccc(CCNC(c2ccc(\C=C3/C(N(Cc4cccc(c4)[Cl])c4ccccc4S3)=O)cc2)=O)cc1OC |
| Stereo: | ACHIRAL |
| logP: | 6.2478 |
| logD: | 6.2478 |
| logSw: | -6.0946 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.585 |
| InChI Key: | ZLSRKWYSJCLLDB-UHFFFAOYSA-N |