3-benzyl-7-[4-(propane-1-sulfonyl)piperazin-1-yl]-3H-[1,2,3]triazolo[4,5-d]pyrimidine
Chemical Structure Depiction of
3-benzyl-7-[4-(propane-1-sulfonyl)piperazin-1-yl]-3H-[1,2,3]triazolo[4,5-d]pyrimidine
3-benzyl-7-[4-(propane-1-sulfonyl)piperazin-1-yl]-3H-[1,2,3]triazolo[4,5-d]pyrimidine
Compound characteristics
| Compound ID: | G867-0216 |
| Compound Name: | 3-benzyl-7-[4-(propane-1-sulfonyl)piperazin-1-yl]-3H-[1,2,3]triazolo[4,5-d]pyrimidine |
| Molecular Weight: | 401.49 |
| Molecular Formula: | C18 H23 N7 O2 S |
| Smiles: | CCCS(N1CCN(CC1)c1c2c(ncn1)n(Cc1ccccc1)nn2)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.7808 |
| logD: | 1.7807 |
| logSw: | -2.3438 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 82.174 |
| InChI Key: | SWRVOBOVBCHHJQ-UHFFFAOYSA-N |