2-chloro-7-(4-methoxyphenyl)-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
2-chloro-7-(4-methoxyphenyl)-6-(thiophen-2-yl)-7,12-dihydro-6H-[1]benzopyrano[4,3-d][1,2,4]triazolo[1,5-a]pyrimidine
2-chloro-7-(4-methoxyphenyl)-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: | K832-2949 |
| Compound Name: | 2-chloro-7-(4-methoxyphenyl)-6-(thiophen-2-yl)-7,12-dihydro-6H-[1]benzopyrano[4,3-d][1,2,4]triazolo[1,5-a]pyrimidine |
| Molecular Weight: | 448.93 |
| Molecular Formula: | C23 H17 Cl N4 O2 S |
| Smiles: | COc1ccc(cc1)C1C2C(c3cccs3)Oc3ccc(cc3C=2Nc2ncnn12)[Cl] |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.1378 |
| logD: | 5.1365 |
| logSw: | -5.6854 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.169 |
| InChI Key: | IIGQRHGMKPKIEP-UHFFFAOYSA-N |