6-(3-bromo-4-methoxyphenyl)-7-(3-methoxyphenyl)-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-(3-methoxyphenyl)-7,12-dihydro-6H-[1]benzopyrano[4,3-d][1,2,4]triazolo[1,5-a]pyrimidine
6-(3-bromo-4-methoxyphenyl)-7-(3-methoxyphenyl)-7,12-dihydro-6H-[1]benzopyrano[4,3-d][1,2,4]triazolo[1,5-a]pyrimidine
Compound characteristics
| Compound ID: | K832-3729 |
| Compound Name: | 6-(3-bromo-4-methoxyphenyl)-7-(3-methoxyphenyl)-7,12-dihydro-6H-[1]benzopyrano[4,3-d][1,2,4]triazolo[1,5-a]pyrimidine |
| Molecular Weight: | 517.38 |
| Molecular Formula: | C26 H21 Br N4 O3 |
| Smiles: | COc1cccc(c1)C1C2C(c3ccc(c(c3)[Br])OC)Oc3ccccc3C=2Nc2ncnn12 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.2811 |
| logD: | 5.2809 |
| logSw: | -5.4228 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.781 |
| InChI Key: | GHTZUMZCMMNKHH-UHFFFAOYSA-N |