7-(4-methoxyphenyl)-6-(3-nitrophenyl)-7,12-dihydro-6H-[1]benzopyrano[4,3-d][1,2,4]triazolo[1,5-a]pyrimidine
Chemical Structure Depiction of
7-(4-methoxyphenyl)-6-(3-nitrophenyl)-7,12-dihydro-6H-[1]benzopyrano[4,3-d][1,2,4]triazolo[1,5-a]pyrimidine
7-(4-methoxyphenyl)-6-(3-nitrophenyl)-7,12-dihydro-6H-[1]benzopyrano[4,3-d][1,2,4]triazolo[1,5-a]pyrimidine
Compound characteristics
| Compound ID: | K832-2857 |
| Compound Name: | 7-(4-methoxyphenyl)-6-(3-nitrophenyl)-7,12-dihydro-6H-[1]benzopyrano[4,3-d][1,2,4]triazolo[1,5-a]pyrimidine |
| Molecular Weight: | 453.46 |
| Molecular Formula: | C25 H19 N5 O4 |
| Smiles: | COc1ccc(cc1)C1C2C(c3cccc(c3)[N+]([O-])=O)Oc3ccccc3C=2Nc2ncnn12 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.6966 |
| logD: | 4.6965 |
| logSw: | -4.5677 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 86.533 |
| InChI Key: | XYFYVSKYSCYJIU-UHFFFAOYSA-N |