2-(9-bromo-5,5-dioxo-5lambda~6~-dibenzo[c,e][1,2]thiazin-6(5H)-yl)-N-{3-[(prop-2-en-1-yl)oxy]phenyl}acetamide
Chemical Structure Depiction of
2-(9-bromo-5,5-dioxo-5lambda~6~-dibenzo[c,e][1,2]thiazin-6(5H)-yl)-N-{3-[(prop-2-en-1-yl)oxy]phenyl}acetamide
2-(9-bromo-5,5-dioxo-5lambda~6~-dibenzo[c,e][1,2]thiazin-6(5H)-yl)-N-{3-[(prop-2-en-1-yl)oxy]phenyl}acetamide
Compound characteristics
| Compound ID: | D289-0323 |
| Compound Name: | 2-(9-bromo-5,5-dioxo-5lambda~6~-dibenzo[c,e][1,2]thiazin-6(5H)-yl)-N-{3-[(prop-2-en-1-yl)oxy]phenyl}acetamide |
| Molecular Weight: | 499.38 |
| Molecular Formula: | C23 H19 Br N2 O4 S |
| Smiles: | C=CCOc1cccc(c1)NC(CN1c2ccc(cc2c2ccccc2S1(=O)=O)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 5.2371 |
| logD: | 5.2371 |
| logSw: | -5.3626 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.329 |
| InChI Key: | DCTRKHLPHHCOFK-UHFFFAOYSA-N |