2-(furan-2-yl)-5,6-dimethyl-7-[4-(4-nitrophenyl)piperazin-1-yl][1,2,4]triazolo[1,5-a]pyrimidine
Chemical Structure Depiction of
2-(furan-2-yl)-5,6-dimethyl-7-[4-(4-nitrophenyl)piperazin-1-yl][1,2,4]triazolo[1,5-a]pyrimidine
2-(furan-2-yl)-5,6-dimethyl-7-[4-(4-nitrophenyl)piperazin-1-yl][1,2,4]triazolo[1,5-a]pyrimidine
Compound characteristics
| Compound ID: | C301-8682 |
| Compound Name: | 2-(furan-2-yl)-5,6-dimethyl-7-[4-(4-nitrophenyl)piperazin-1-yl][1,2,4]triazolo[1,5-a]pyrimidine |
| Molecular Weight: | 419.44 |
| Molecular Formula: | C21 H21 N7 O3 |
| Smiles: | Cc1c(C)nc2nc(c3ccco3)nn2c1N1CCN(CC1)c1ccc(cc1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 3.7952 |
| logD: | 3.6797 |
| logSw: | -3.9709 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 78.583 |
| InChI Key: | XSLUCACEPQJTDH-UHFFFAOYSA-N |