2-chloro-6-(3-methoxyphenyl)-7-(4-methoxyphenyl)-7,12-dihydro-6H-[1]benzopyrano[4,3-d][1,2,4]triazolo[1,5-a]pyrimidine
Chemical Structure Depiction of
2-chloro-6-(3-methoxyphenyl)-7-(4-methoxyphenyl)-7,12-dihydro-6H-[1]benzopyrano[4,3-d][1,2,4]triazolo[1,5-a]pyrimidine
2-chloro-6-(3-methoxyphenyl)-7-(4-methoxyphenyl)-7,12-dihydro-6H-[1]benzopyrano[4,3-d][1,2,4]triazolo[1,5-a]pyrimidine
Compound characteristics
| Compound ID: | K832-2933 |
| Compound Name: | 2-chloro-6-(3-methoxyphenyl)-7-(4-methoxyphenyl)-7,12-dihydro-6H-[1]benzopyrano[4,3-d][1,2,4]triazolo[1,5-a]pyrimidine |
| Molecular Weight: | 472.93 |
| Molecular Formula: | C26 H21 Cl N4 O3 |
| Smiles: | COc1ccc(cc1)C1C2C(c3cccc(c3)OC)Oc3ccc(cc3C=2Nc2ncnn12)[Cl] |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.5437 |
| logD: | 5.5428 |
| logSw: | -6.2352 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.695 |
| InChI Key: | ZGFCSCDBXOXAJB-UHFFFAOYSA-N |