6-(4-bromophenyl)-7-(4-chlorophenyl)-7,12-dihydro-6H-[1]benzopyrano[4,3-d][1,2,4]triazolo[1,5-a]pyrimidine
Chemical Structure Depiction of
6-(4-bromophenyl)-7-(4-chlorophenyl)-7,12-dihydro-6H-[1]benzopyrano[4,3-d][1,2,4]triazolo[1,5-a]pyrimidine
6-(4-bromophenyl)-7-(4-chlorophenyl)-7,12-dihydro-6H-[1]benzopyrano[4,3-d][1,2,4]triazolo[1,5-a]pyrimidine
Compound characteristics
| Compound ID: | K832-2848 |
| Compound Name: | 6-(4-bromophenyl)-7-(4-chlorophenyl)-7,12-dihydro-6H-[1]benzopyrano[4,3-d][1,2,4]triazolo[1,5-a]pyrimidine |
| Molecular Weight: | 491.77 |
| Molecular Formula: | C24 H16 Br Cl N4 O |
| Smiles: | c1ccc2c(c1)C1=C(C(c3ccc(cc3)[Cl])n3c(N1)ncn3)C(c1ccc(cc1)[Br])O2 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 6.3001 |
| logD: | 6.3 |
| logSw: | -6.6613 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 45.607 |
| InChI Key: | XXUDUUOHTHFDFB-UHFFFAOYSA-N |