3-benzoyl-1,1-dioxo-2-(prop-2-en-1-yl)-1,2-dihydro-1lambda~6~,2-benzothiazin-4-yl phenoxyacetate
Chemical Structure Depiction of
3-benzoyl-1,1-dioxo-2-(prop-2-en-1-yl)-1,2-dihydro-1lambda~6~,2-benzothiazin-4-yl phenoxyacetate
3-benzoyl-1,1-dioxo-2-(prop-2-en-1-yl)-1,2-dihydro-1lambda~6~,2-benzothiazin-4-yl phenoxyacetate
Compound characteristics
Compound ID: | 6405-0064 |
Compound Name: | 3-benzoyl-1,1-dioxo-2-(prop-2-en-1-yl)-1,2-dihydro-1lambda~6~,2-benzothiazin-4-yl phenoxyacetate |
Molecular Weight: | 475.52 |
Molecular Formula: | C26 H21 N O6 S |
Smiles: | C=CCN1C(=C(c2ccccc2S1(=O)=O)OC(COc1ccccc1)=O)C(c1ccccc1)=O |
Stereo: | ACHIRAL |
logP: | 4.2944 |
logD: | 4.2944 |
logSw: | -4.5569 |
Hydrogen bond acceptors count: | 10 |
Polar surface area: | 72.989 |
InChI Key: | FUFWJXZDRQRPPG-UHFFFAOYSA-N |