5-(4-benzylpiperazin-1-yl)-3-(2,5-dimethylbenzene-1-sulfonyl)thieno[2,3-e][1,2,3]triazolo[1,5-a]pyrimidine
Chemical Structure Depiction of
5-(4-benzylpiperazin-1-yl)-3-(2,5-dimethylbenzene-1-sulfonyl)thieno[2,3-e][1,2,3]triazolo[1,5-a]pyrimidine
5-(4-benzylpiperazin-1-yl)-3-(2,5-dimethylbenzene-1-sulfonyl)thieno[2,3-e][1,2,3]triazolo[1,5-a]pyrimidine
Compound characteristics
| Compound ID: | E565-0971 |
| Compound Name: | 5-(4-benzylpiperazin-1-yl)-3-(2,5-dimethylbenzene-1-sulfonyl)thieno[2,3-e][1,2,3]triazolo[1,5-a]pyrimidine |
| Molecular Weight: | 518.66 |
| Molecular Formula: | C26 H26 N6 O2 S2 |
| Smiles: | Cc1ccc(C)c(c1)S(c1c2nc(c3c(ccs3)n2nn1)N1CCN(CC1)Cc1ccccc1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.0329 |
| logD: | 4.944 |
| logSw: | -4.6584 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 69.687 |
| InChI Key: | BUNJMVCKFFQYPF-UHFFFAOYSA-N |