3-(4-bromobenzene-1-sulfonyl)-N-[3-(trifluoromethyl)phenyl]thieno[2,3-e][1,2,3]triazolo[1,5-a]pyrimidin-5-amine
Chemical Structure Depiction of
3-(4-bromobenzene-1-sulfonyl)-N-[3-(trifluoromethyl)phenyl]thieno[2,3-e][1,2,3]triazolo[1,5-a]pyrimidin-5-amine
3-(4-bromobenzene-1-sulfonyl)-N-[3-(trifluoromethyl)phenyl]thieno[2,3-e][1,2,3]triazolo[1,5-a]pyrimidin-5-amine
Compound characteristics
| Compound ID: | E565-0842 |
| Compound Name: | 3-(4-bromobenzene-1-sulfonyl)-N-[3-(trifluoromethyl)phenyl]thieno[2,3-e][1,2,3]triazolo[1,5-a]pyrimidin-5-amine |
| Molecular Weight: | 554.37 |
| Molecular Formula: | C20 H11 Br F3 N5 O2 S2 |
| Smiles: | c1cc(cc(c1)Nc1c2c(ccs2)n2c(c(nn2)S(c2ccc(cc2)[Br])(=O)=O)n1)C(F)(F)F |
| Stereo: | ACHIRAL |
| logP: | 6.2929 |
| logD: | 6.2929 |
| logSw: | -6.3935 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.313 |
| InChI Key: | KWIIKVJNDMCIIO-UHFFFAOYSA-N |