5-(4-chlorophenyl)-7-(2,4,5-trimethoxyphenyl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine
Chemical Structure Depiction of
5-(4-chlorophenyl)-7-(2,4,5-trimethoxyphenyl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine
5-(4-chlorophenyl)-7-(2,4,5-trimethoxyphenyl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine
Compound characteristics
Compound ID: | K832-1442 |
Compound Name: | 5-(4-chlorophenyl)-7-(2,4,5-trimethoxyphenyl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine |
Molecular Weight: | 398.85 |
Molecular Formula: | C20 H19 Cl N4 O3 |
Smiles: | COc1cc(c(cc1C1C=C(c2ccc(cc2)[Cl])Nc2ncnn12)OC)OC |
Stereo: | RACEMIC MIXTURE |
logP: | 3.7172 |
logD: | 3.708 |
logSw: | -4.2607 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 61.491 |
InChI Key: | NMHGXDPFKWPOCZ-MRXNPFEDSA-N |