ethyl 7-(2,3-dimethoxyphenyl)-2-(ethylsulfanyl)-5-methyl-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate
Chemical Structure Depiction of
ethyl 7-(2,3-dimethoxyphenyl)-2-(ethylsulfanyl)-5-methyl-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate
ethyl 7-(2,3-dimethoxyphenyl)-2-(ethylsulfanyl)-5-methyl-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate
Compound characteristics
| Compound ID: | C202-2590 |
| Compound Name: | ethyl 7-(2,3-dimethoxyphenyl)-2-(ethylsulfanyl)-5-methyl-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate |
| Molecular Weight: | 404.49 |
| Molecular Formula: | C19 H24 N4 O4 S |
| Smiles: | CCOC(C1C(c2cccc(c2OC)OC)n2c(NC=1C)nc(n2)SCC)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.6768 |
| logD: | 3.5084 |
| logSw: | -3.8809 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.872 |
| InChI Key: | XMXAXGIFADKCSX-HNNXBMFYSA-N |