5-(4-chlorophenyl)-7-(4-ethoxy-3-methoxyphenyl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine
Chemical Structure Depiction of
5-(4-chlorophenyl)-7-(4-ethoxy-3-methoxyphenyl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine
5-(4-chlorophenyl)-7-(4-ethoxy-3-methoxyphenyl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine
Compound characteristics
Compound ID: | K832-2961 |
Compound Name: | 5-(4-chlorophenyl)-7-(4-ethoxy-3-methoxyphenyl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine |
Molecular Weight: | 382.85 |
Molecular Formula: | C20 H19 Cl N4 O2 |
Smiles: | CCOc1ccc(cc1OC)C1C=C(c2ccc(cc2)[Cl])Nc2ncnn12 |
Stereo: | RACEMIC MIXTURE |
logP: | 4.2698 |
logD: | 4.2606 |
logSw: | -4.7862 |
Hydrogen bond acceptors count: | 4 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 53.441 |
InChI Key: | HXDBAHCIVUETPC-QGZVFWFLSA-N |