4-(2,3-dihydro-4H-1,4-benzothiazin-4-yl)-N-[(2-methylphenyl)methyl]-4-oxobutanamide
Chemical Structure Depiction of
4-(2,3-dihydro-4H-1,4-benzothiazin-4-yl)-N-[(2-methylphenyl)methyl]-4-oxobutanamide
4-(2,3-dihydro-4H-1,4-benzothiazin-4-yl)-N-[(2-methylphenyl)methyl]-4-oxobutanamide
Compound characteristics
| Compound ID: | E539-0296 |
| Compound Name: | 4-(2,3-dihydro-4H-1,4-benzothiazin-4-yl)-N-[(2-methylphenyl)methyl]-4-oxobutanamide |
| Molecular Weight: | 354.47 |
| Molecular Formula: | C20 H22 N2 O2 S |
| Smiles: | Cc1ccccc1CNC(CCC(N1CCSc2ccccc12)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3531 |
| logD: | 3.3531 |
| logSw: | -3.5161 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 39.495 |
| InChI Key: | KEMHNVBIMOAVMG-UHFFFAOYSA-N |