4-acetyl-N-(6-ethoxy-1,3-benzothiazol-2-yl)-3,4-dihydro-2H-1,4-benzothiazine-6-sulfonamide
Chemical Structure Depiction of
4-acetyl-N-(6-ethoxy-1,3-benzothiazol-2-yl)-3,4-dihydro-2H-1,4-benzothiazine-6-sulfonamide
4-acetyl-N-(6-ethoxy-1,3-benzothiazol-2-yl)-3,4-dihydro-2H-1,4-benzothiazine-6-sulfonamide
Compound characteristics
Compound ID: | F053-0441 |
Compound Name: | 4-acetyl-N-(6-ethoxy-1,3-benzothiazol-2-yl)-3,4-dihydro-2H-1,4-benzothiazine-6-sulfonamide |
Molecular Weight: | 449.57 |
Molecular Formula: | C19 H19 N3 O4 S3 |
Smiles: | CCOc1ccc2c(c1)sc(NS(c1ccc3c(c1)N(CCS3)C(C)=O)(=O)=O)n2 |
Stereo: | ACHIRAL |
logP: | 3.74 |
logD: | 3.5074 |
logSw: | -3.9543 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 73.825 |
InChI Key: | SZJFGFAODYFUHN-UHFFFAOYSA-N |