6-(4-methoxyphenyl)-7-(thiophen-2-yl)-7,12-dihydro-6H-[1]benzopyrano[4,3-d][1,2,4]triazolo[1,5-a]pyrimidine
Chemical Structure Depiction of
6-(4-methoxyphenyl)-7-(thiophen-2-yl)-7,12-dihydro-6H-[1]benzopyrano[4,3-d][1,2,4]triazolo[1,5-a]pyrimidine
6-(4-methoxyphenyl)-7-(thiophen-2-yl)-7,12-dihydro-6H-[1]benzopyrano[4,3-d][1,2,4]triazolo[1,5-a]pyrimidine
Compound characteristics
Compound ID: | K832-2886 |
Compound Name: | 6-(4-methoxyphenyl)-7-(thiophen-2-yl)-7,12-dihydro-6H-[1]benzopyrano[4,3-d][1,2,4]triazolo[1,5-a]pyrimidine |
Molecular Weight: | 414.48 |
Molecular Formula: | C23 H18 N4 O2 S |
Smiles: | COc1ccc(cc1)C1C2C(c3cccs3)n3c(NC=2c2ccccc2O1)ncn3 |
Stereo: | MIXTURE OF STEREOISOMERS |
logP: | 4.4781 |
logD: | 4.4779 |
logSw: | -4.511 |
Hydrogen bond acceptors count: | 4 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 54.169 |
InChI Key: | DSVOYVNWGMJQFR-UHFFFAOYSA-N |