2-[3-acetyl-5-(5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)-2,3-dihydro-1,3,4-oxadiazol-2-yl]-6-methoxy-4-nitrophenyl acetate
Chemical Structure Depiction of
2-[3-acetyl-5-(5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)-2,3-dihydro-1,3,4-oxadiazol-2-yl]-6-methoxy-4-nitrophenyl acetate
2-[3-acetyl-5-(5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)-2,3-dihydro-1,3,4-oxadiazol-2-yl]-6-methoxy-4-nitrophenyl acetate
Compound characteristics
| Compound ID: | G642-1749 |
| Compound Name: | 2-[3-acetyl-5-(5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)-2,3-dihydro-1,3,4-oxadiazol-2-yl]-6-methoxy-4-nitrophenyl acetate |
| Molecular Weight: | 469.41 |
| Molecular Formula: | C20 H19 N7 O7 |
| Smiles: | CC(N1C(c2cc(cc(c2OC(C)=O)OC)[N+]([O-])=O)OC(c2nc3nc(C)cc(C)n3n2)=N1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.2139 |
| logD: | 1.2139 |
| logSw: | -1.784 |
| Hydrogen bond acceptors count: | 15 |
| Polar surface area: | 127.779 |
| InChI Key: | YEFDBEVXRDWTSY-IBGZPJMESA-N |