N-(2,3-dimethylphenyl)-3-(3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-sulfonyl)propanamide
Chemical Structure Depiction of
N-(2,3-dimethylphenyl)-3-(3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-sulfonyl)propanamide
N-(2,3-dimethylphenyl)-3-(3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-sulfonyl)propanamide
Compound characteristics
Compound ID: | E511-1048 |
Compound Name: | N-(2,3-dimethylphenyl)-3-(3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-sulfonyl)propanamide |
Molecular Weight: | 404.51 |
Molecular Formula: | C19 H20 N2 O4 S2 |
Smiles: | Cc1cccc(c1C)NC(CCS(c1ccc2c(c1)NC(CS2)=O)(=O)=O)=O |
Stereo: | ACHIRAL |
logP: | 2.14 |
logD: | 2.14 |
logSw: | -2.691 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 76.275 |
InChI Key: | QWUAZDPTFAOJLN-UHFFFAOYSA-N |