N-(2,2-dimethoxyethyl)-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-dimethoxyethyl)-4-({4-[(3-methylphenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-ylidene}methyl)benzamide
N-(2,2-dimethoxyethyl)-4-({4-[(3-methylphenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-ylidene}methyl)benzamide
Compound characteristics
| Compound ID: | K788-7939 |
| Compound Name: | N-(2,2-dimethoxyethyl)-4-({4-[(3-methylphenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-ylidene}methyl)benzamide |
| Molecular Weight: | 488.61 |
| Molecular Formula: | C28 H28 N2 O4 S |
| Smiles: | Cc1cccc(CN2C(/C(=C\c3ccc(cc3)C(NCC(OC)OC)=O)Sc3ccccc23)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 4.8371 |
| logD: | 4.837 |
| logSw: | -4.5463 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.249 |
| InChI Key: | YTHYXUBABHGYHG-UHFFFAOYSA-N |