5-[4-(4-nitrophenyl)piperazin-1-yl]-7-propyl[1,2,4]triazolo[4,3-a]pyrimidine
Chemical Structure Depiction of
5-[4-(4-nitrophenyl)piperazin-1-yl]-7-propyl[1,2,4]triazolo[4,3-a]pyrimidine
5-[4-(4-nitrophenyl)piperazin-1-yl]-7-propyl[1,2,4]triazolo[4,3-a]pyrimidine
Compound characteristics
| Compound ID: | D165-0358 |
| Compound Name: | 5-[4-(4-nitrophenyl)piperazin-1-yl]-7-propyl[1,2,4]triazolo[4,3-a]pyrimidine |
| Molecular Weight: | 367.41 |
| Molecular Formula: | C18 H21 N7 O2 |
| Smiles: | CCCc1cc(N2CCN(CC2)c2ccc(cc2)[N+]([O-])=O)n2cnnc2n1 |
| Stereo: | ACHIRAL |
| logP: | 3.2885 |
| logD: | 3.2554 |
| logSw: | -3.4658 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 71.838 |
| InChI Key: | KGCUKENMICARCI-UHFFFAOYSA-N |