2-{5-[(4-nitrophenoxy)methyl]furan-2-yl}-7-phenyl-7H-pyrazolo[4,3-e][1,2,4]triazolo[1,5-c]pyrimidine
Chemical Structure Depiction of
2-{5-[(4-nitrophenoxy)methyl]furan-2-yl}-7-phenyl-7H-pyrazolo[4,3-e][1,2,4]triazolo[1,5-c]pyrimidine
2-{5-[(4-nitrophenoxy)methyl]furan-2-yl}-7-phenyl-7H-pyrazolo[4,3-e][1,2,4]triazolo[1,5-c]pyrimidine
Compound characteristics
| Compound ID: | Y502-3899 |
| Compound Name: | 2-{5-[(4-nitrophenoxy)methyl]furan-2-yl}-7-phenyl-7H-pyrazolo[4,3-e][1,2,4]triazolo[1,5-c]pyrimidine |
| Molecular Weight: | 453.42 |
| Molecular Formula: | C23 H15 N7 O4 |
| Smiles: | C(c1ccc(c2nc3c4cnn(c5ccccc5)c4ncn3n2)o1)Oc1ccc(cc1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 4.3863 |
| logD: | 4.385 |
| logSw: | -4.4059 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 92.892 |
| InChI Key: | HBCUVIIJQSEWLX-UHFFFAOYSA-N |