5-(azepan-1-yl)-3-(4-bromobenzene-1-sulfonyl)thieno[2,3-e][1,2,3]triazolo[1,5-a]pyrimidine
Chemical Structure Depiction of
5-(azepan-1-yl)-3-(4-bromobenzene-1-sulfonyl)thieno[2,3-e][1,2,3]triazolo[1,5-a]pyrimidine
5-(azepan-1-yl)-3-(4-bromobenzene-1-sulfonyl)thieno[2,3-e][1,2,3]triazolo[1,5-a]pyrimidine
Compound characteristics
| Compound ID: | E565-0796 |
| Compound Name: | 5-(azepan-1-yl)-3-(4-bromobenzene-1-sulfonyl)thieno[2,3-e][1,2,3]triazolo[1,5-a]pyrimidine |
| Molecular Weight: | 492.41 |
| Molecular Formula: | C19 H18 Br N5 O2 S2 |
| Smiles: | C1CCCN(CC1)c1c2c(ccs2)n2c(c(nn2)S(c2ccc(cc2)[Br])(=O)=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 5.4459 |
| logD: | 5.4459 |
| logSw: | -5.6347 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 66.478 |
| InChI Key: | QKHPRPXFAVBIAP-UHFFFAOYSA-N |