2-[(8-bromo-5-methyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]-N-[4-(trifluoromethoxy)phenyl]acetamide
Chemical Structure Depiction of
2-[(8-bromo-5-methyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]-N-[4-(trifluoromethoxy)phenyl]acetamide
2-[(8-bromo-5-methyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]-N-[4-(trifluoromethoxy)phenyl]acetamide
Compound characteristics
| Compound ID: | 8010-7845 |
| Compound Name: | 2-[(8-bromo-5-methyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]-N-[4-(trifluoromethoxy)phenyl]acetamide |
| Molecular Weight: | 512.31 |
| Molecular Formula: | C19 H13 Br F3 N5 O2 S |
| Smiles: | Cn1c2ccc(cc2c2c1nc(nn2)SCC(Nc1ccc(cc1)OC(F)(F)F)=O)[Br] |
| Stereo: | ACHIRAL |
| logP: | 5.0283 |
| logD: | 5.0283 |
| logSw: | -4.7852 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.874 |
| InChI Key: | ZNZQAGLDBDSOGG-UHFFFAOYSA-N |