3-benzoyl-1,1-dioxo-2-(prop-2-en-1-yl)-1,2-dihydro-1lambda~6~,2-benzothiazin-4-yl phenylacetate
Chemical Structure Depiction of
3-benzoyl-1,1-dioxo-2-(prop-2-en-1-yl)-1,2-dihydro-1lambda~6~,2-benzothiazin-4-yl phenylacetate
3-benzoyl-1,1-dioxo-2-(prop-2-en-1-yl)-1,2-dihydro-1lambda~6~,2-benzothiazin-4-yl phenylacetate
Compound characteristics
| Compound ID: | 5149-0174 |
| Compound Name: | 3-benzoyl-1,1-dioxo-2-(prop-2-en-1-yl)-1,2-dihydro-1lambda~6~,2-benzothiazin-4-yl phenylacetate |
| Molecular Weight: | 459.52 |
| Molecular Formula: | C26 H21 N O5 S |
| Smiles: | C=CCN1C(=C(c2ccccc2S1(=O)=O)OC(Cc1ccccc1)=O)C(c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.7243 |
| logD: | 4.7243 |
| logSw: | -4.962 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 65.49 |
| InChI Key: | OLYVXQUVPDYCLJ-UHFFFAOYSA-N |