6-(3-bromo-4-methoxyphenyl)-7-(4-methylphenyl)-7,12-dihydro-6H-[1]benzopyrano[4,3-d][1,2,4]triazolo[1,5-a]pyrimidine
Chemical Structure Depiction of
6-(3-bromo-4-methoxyphenyl)-7-(4-methylphenyl)-7,12-dihydro-6H-[1]benzopyrano[4,3-d][1,2,4]triazolo[1,5-a]pyrimidine
6-(3-bromo-4-methoxyphenyl)-7-(4-methylphenyl)-7,12-dihydro-6H-[1]benzopyrano[4,3-d][1,2,4]triazolo[1,5-a]pyrimidine
Compound characteristics
| Compound ID: | K832-3784 |
| Compound Name: | 6-(3-bromo-4-methoxyphenyl)-7-(4-methylphenyl)-7,12-dihydro-6H-[1]benzopyrano[4,3-d][1,2,4]triazolo[1,5-a]pyrimidine |
| Molecular Weight: | 501.38 |
| Molecular Formula: | C26 H21 Br N4 O2 |
| Smiles: | Cc1ccc(cc1)C1C2C(c3ccc(c(c3)[Br])OC)Oc3ccccc3C=2Nc2ncnn12 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.6842 |
| logD: | 5.6841 |
| logSw: | -5.6694 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.238 |
| InChI Key: | ADIVPTJYOJLNSH-UHFFFAOYSA-N |