N-[3-benzoyl-1,1-dioxo-2-(prop-2-en-1-yl)-1,2-dihydro-1lambda~6~,2-benzothiazin-4-yl]-2-(4-methylphenoxy)acetamide
Chemical Structure Depiction of
N-[3-benzoyl-1,1-dioxo-2-(prop-2-en-1-yl)-1,2-dihydro-1lambda~6~,2-benzothiazin-4-yl]-2-(4-methylphenoxy)acetamide
N-[3-benzoyl-1,1-dioxo-2-(prop-2-en-1-yl)-1,2-dihydro-1lambda~6~,2-benzothiazin-4-yl]-2-(4-methylphenoxy)acetamide
Compound characteristics
| Compound ID: | D097-0016 |
| Compound Name: | N-[3-benzoyl-1,1-dioxo-2-(prop-2-en-1-yl)-1,2-dihydro-1lambda~6~,2-benzothiazin-4-yl]-2-(4-methylphenoxy)acetamide |
| Molecular Weight: | 488.56 |
| Molecular Formula: | C27 H24 N2 O5 S |
| Smiles: | Cc1ccc(cc1)OCC(NC1=C(C(c2ccccc2)=O)N(CC=C)S(c2ccccc12)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.6738 |
| logD: | 1.4254 |
| logSw: | -4.5006 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 75.965 |
| InChI Key: | XXUCHNNMBWYHST-UHFFFAOYSA-N |