N-(3-benzoyl-2-methyl-1,1-dioxo-1,2-dihydro-1lambda~6~,2-benzothiazin-4-yl)-2-(4-methylphenoxy)acetamide
Chemical Structure Depiction of
N-(3-benzoyl-2-methyl-1,1-dioxo-1,2-dihydro-1lambda~6~,2-benzothiazin-4-yl)-2-(4-methylphenoxy)acetamide
N-(3-benzoyl-2-methyl-1,1-dioxo-1,2-dihydro-1lambda~6~,2-benzothiazin-4-yl)-2-(4-methylphenoxy)acetamide
Compound characteristics
Compound ID: | D097-0003 |
Compound Name: | N-(3-benzoyl-2-methyl-1,1-dioxo-1,2-dihydro-1lambda~6~,2-benzothiazin-4-yl)-2-(4-methylphenoxy)acetamide |
Molecular Weight: | 462.52 |
Molecular Formula: | C25 H22 N2 O5 S |
Smiles: | Cc1ccc(cc1)OCC(NC1=C(C(c2ccccc2)=O)N(C)S(c2ccccc12)(=O)=O)=O |
Stereo: | ACHIRAL |
logP: | 4.6295 |
logD: | 1.3898 |
logSw: | -4.4671 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 76.992 |
InChI Key: | IWUDKEMUNIJBEH-UHFFFAOYSA-N |