N-(2-nitrophenyl)-2-(3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-yl)acetamide
Chemical Structure Depiction of
N-(2-nitrophenyl)-2-(3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-yl)acetamide
N-(2-nitrophenyl)-2-(3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-yl)acetamide
Compound characteristics
Compound ID: | 3992-0902 |
Compound Name: | N-(2-nitrophenyl)-2-(3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-yl)acetamide |
Molecular Weight: | 343.36 |
Molecular Formula: | C16 H13 N3 O4 S |
Smiles: | C(C1C(Nc2ccccc2S1)=O)C(Nc1ccccc1[N+]([O-])=O)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 2.4582 |
logD: | 2.3725 |
logSw: | -2.8028 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 80.377 |
InChI Key: | PYPLLNCCLNXPDB-AWEZNQCLSA-N |