ethyl 7-(2,4-dimethoxyphenyl)-2-[(2-methoxy-2-oxoethyl)sulfanyl]-5-methyl-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate
Chemical Structure Depiction of
ethyl 7-(2,4-dimethoxyphenyl)-2-[(2-methoxy-2-oxoethyl)sulfanyl]-5-methyl-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate
ethyl 7-(2,4-dimethoxyphenyl)-2-[(2-methoxy-2-oxoethyl)sulfanyl]-5-methyl-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate
Compound characteristics
| Compound ID: | Y020-7849 |
| Compound Name: | ethyl 7-(2,4-dimethoxyphenyl)-2-[(2-methoxy-2-oxoethyl)sulfanyl]-5-methyl-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate |
| Molecular Weight: | 448.5 |
| Molecular Formula: | C20 H24 N4 O6 S |
| Smiles: | CCOC(C1C(c2ccc(cc2OC)OC)n2c(NC=1C)nc(n2)SCC(=O)OC)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.9978 |
| logD: | 2.8968 |
| logSw: | -3.3733 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 92.278 |
| InChI Key: | RUFBZEZATKKWKP-KRWDZBQOSA-N |