N-[2-(2,5-dimethoxyphenyl)ethyl]-4-({4-[(3-methylphenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-ylidene}methyl)benzamide
Chemical Structure Depiction of
N-[2-(2,5-dimethoxyphenyl)ethyl]-4-({4-[(3-methylphenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-ylidene}methyl)benzamide
N-[2-(2,5-dimethoxyphenyl)ethyl]-4-({4-[(3-methylphenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-ylidene}methyl)benzamide
Compound characteristics
Compound ID: | K788-9600 |
Compound Name: | N-[2-(2,5-dimethoxyphenyl)ethyl]-4-({4-[(3-methylphenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-ylidene}methyl)benzamide |
Molecular Weight: | 564.7 |
Molecular Formula: | C34 H32 N2 O4 S |
Smiles: | Cc1cccc(CN2C(/C(=C\c3ccc(cc3)C(NCCc3cc(ccc3OC)OC)=O)Sc3ccccc23)=O)c1 |
Stereo: | ACHIRAL |
logP: | 7.0714 |
logD: | 7.0714 |
logSw: | -5.6565 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 54.499 |
InChI Key: | ABTGRHMPNONSSS-UHFFFAOYSA-N |