4-{[3-(7-phenyl-7H-pyrazolo[4,3-e][1,2,4]triazolo[1,5-c]pyrimidin-2-yl)phenyl]methoxy}benzonitrile
Chemical Structure Depiction of
4-{[3-(7-phenyl-7H-pyrazolo[4,3-e][1,2,4]triazolo[1,5-c]pyrimidin-2-yl)phenyl]methoxy}benzonitrile
4-{[3-(7-phenyl-7H-pyrazolo[4,3-e][1,2,4]triazolo[1,5-c]pyrimidin-2-yl)phenyl]methoxy}benzonitrile
Compound characteristics
| Compound ID: | Y500-4319 |
| Compound Name: | 4-{[3-(7-phenyl-7H-pyrazolo[4,3-e][1,2,4]triazolo[1,5-c]pyrimidin-2-yl)phenyl]methoxy}benzonitrile |
| Molecular Weight: | 443.47 |
| Molecular Formula: | C26 H17 N7 O |
| Smiles: | C(c1cccc(c1)c1nc2c3cnn(c4ccccc4)c3ncn2n1)Oc1ccc(C#N)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.7999 |
| logD: | 4.7946 |
| logSw: | -5.0436 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 68.725 |
| InChI Key: | HFRIISIKLDXOOT-UHFFFAOYSA-N |