4-(2,3-dihydro-4H-1,4-benzothiazin-4-yl)-N-(3-methoxyphenyl)-4-oxobutanamide
Chemical Structure Depiction of
4-(2,3-dihydro-4H-1,4-benzothiazin-4-yl)-N-(3-methoxyphenyl)-4-oxobutanamide
4-(2,3-dihydro-4H-1,4-benzothiazin-4-yl)-N-(3-methoxyphenyl)-4-oxobutanamide
Compound characteristics
| Compound ID: | E539-0079 |
| Compound Name: | 4-(2,3-dihydro-4H-1,4-benzothiazin-4-yl)-N-(3-methoxyphenyl)-4-oxobutanamide |
| Molecular Weight: | 356.44 |
| Molecular Formula: | C19 H20 N2 O3 S |
| Smiles: | COc1cccc(c1)NC(CCC(N1CCSc2ccccc12)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8313 |
| logD: | 2.8313 |
| logSw: | -3.4927 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 45.717 |
| InChI Key: | MLDDOFNERWPCEV-UHFFFAOYSA-N |