6-(3-bromo-4-methoxyphenyl)-7-(4-fluorophenyl)-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-fluorophenyl)-7,12-dihydro-6H-[1]benzopyrano[4,3-d][1,2,4]triazolo[1,5-a]pyrimidine
6-(3-bromo-4-methoxyphenyl)-7-(4-fluorophenyl)-7,12-dihydro-6H-[1]benzopyrano[4,3-d][1,2,4]triazolo[1,5-a]pyrimidine
Compound characteristics
| Compound ID: | K832-3717 |
| Compound Name: | 6-(3-bromo-4-methoxyphenyl)-7-(4-fluorophenyl)-7,12-dihydro-6H-[1]benzopyrano[4,3-d][1,2,4]triazolo[1,5-a]pyrimidine |
| Molecular Weight: | 505.35 |
| Molecular Formula: | C25 H18 Br F N4 O2 |
| Smiles: | COc1ccc(cc1[Br])C1C2C(c3ccc(cc3)F)n3c(NC=2c2ccccc2O1)ncn3 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.2899 |
| logD: | 5.2898 |
| logSw: | -5.5592 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.238 |
| InChI Key: | MFHGHIUWSIAZBD-UHFFFAOYSA-N |