7-(4-methylphenyl)-6-(thiophen-2-yl)-7,12-dihydro-6H-[1]benzopyrano[4,3-d][1,2,4]triazolo[1,5-a]pyrimidine
Chemical Structure Depiction of
7-(4-methylphenyl)-6-(thiophen-2-yl)-7,12-dihydro-6H-[1]benzopyrano[4,3-d][1,2,4]triazolo[1,5-a]pyrimidine
7-(4-methylphenyl)-6-(thiophen-2-yl)-7,12-dihydro-6H-[1]benzopyrano[4,3-d][1,2,4]triazolo[1,5-a]pyrimidine
Compound characteristics
| Compound ID: | K832-2863 |
| Compound Name: | 7-(4-methylphenyl)-6-(thiophen-2-yl)-7,12-dihydro-6H-[1]benzopyrano[4,3-d][1,2,4]triazolo[1,5-a]pyrimidine |
| Molecular Weight: | 398.49 |
| Molecular Formula: | C23 H18 N4 O S |
| Smiles: | Cc1ccc(cc1)C1C2C(c3cccs3)Oc3ccccc3C=2Nc2ncnn12 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.8796 |
| logD: | 4.8794 |
| logSw: | -4.6657 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.626 |
| InChI Key: | NAWVBLZNAIAHLQ-UHFFFAOYSA-N |