ethyl 5-methyl-7-(2-methylphenyl)-2-[(2-methylpropyl)sulfanyl]-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate
Chemical Structure Depiction of
ethyl 5-methyl-7-(2-methylphenyl)-2-[(2-methylpropyl)sulfanyl]-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate
ethyl 5-methyl-7-(2-methylphenyl)-2-[(2-methylpropyl)sulfanyl]-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate
Compound characteristics
| Compound ID: | C202-2269 |
| Compound Name: | ethyl 5-methyl-7-(2-methylphenyl)-2-[(2-methylpropyl)sulfanyl]-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate |
| Molecular Weight: | 386.51 |
| Molecular Formula: | C20 H26 N4 O2 S |
| Smiles: | CCOC(C1C(c2ccccc2C)n2c(NC=1C)nc(n2)SCC(C)C)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.0364 |
| logD: | 4.8681 |
| logSw: | -4.5142 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.525 |
| InChI Key: | IHAJGFCQGQJMOY-KRWDZBQOSA-N |