2-[2-(azepane-1-carbonyl)-3-oxo-2,3-dihydro-4H-1,4-benzothiazin-4-yl]-N-(3-cyanophenyl)acetamide
Chemical Structure Depiction of
2-[2-(azepane-1-carbonyl)-3-oxo-2,3-dihydro-4H-1,4-benzothiazin-4-yl]-N-(3-cyanophenyl)acetamide
2-[2-(azepane-1-carbonyl)-3-oxo-2,3-dihydro-4H-1,4-benzothiazin-4-yl]-N-(3-cyanophenyl)acetamide
Compound characteristics
| Compound ID: | L592-2106 |
| Compound Name: | 2-[2-(azepane-1-carbonyl)-3-oxo-2,3-dihydro-4H-1,4-benzothiazin-4-yl]-N-(3-cyanophenyl)acetamide |
| Molecular Weight: | 448.54 |
| Molecular Formula: | C24 H24 N4 O3 S |
| Smiles: | C1CCCN(CC1)C(C1C(N(CC(Nc2cccc(C#N)c2)=O)c2ccccc2S1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.5053 |
| logD: | 3.5051 |
| logSw: | -3.8585 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.526 |
| InChI Key: | FDFIVTPHBPVYLL-QFIPXVFZSA-N |