2-(9-bromo-5,5-dioxo-5lambda~6~-dibenzo[c,e][1,2]thiazin-6(5H)-yl)-N-[(4-methoxyphenyl)methyl]acetamide
Chemical Structure Depiction of
2-(9-bromo-5,5-dioxo-5lambda~6~-dibenzo[c,e][1,2]thiazin-6(5H)-yl)-N-[(4-methoxyphenyl)methyl]acetamide
2-(9-bromo-5,5-dioxo-5lambda~6~-dibenzo[c,e][1,2]thiazin-6(5H)-yl)-N-[(4-methoxyphenyl)methyl]acetamide
Compound characteristics
| Compound ID: | D289-0298 |
| Compound Name: | 2-(9-bromo-5,5-dioxo-5lambda~6~-dibenzo[c,e][1,2]thiazin-6(5H)-yl)-N-[(4-methoxyphenyl)methyl]acetamide |
| Molecular Weight: | 487.37 |
| Molecular Formula: | C22 H19 Br N2 O4 S |
| Smiles: | COc1ccc(CNC(CN2c3ccc(cc3c3ccccc3S2(=O)=O)[Br])=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.1792 |
| logD: | 4.1792 |
| logSw: | -4.314 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.777 |
| InChI Key: | UUTOZNSQWYWVAK-UHFFFAOYSA-N |