methyl 3-[2-(4-ethoxyphenyl)ethyl]-1,2,3,4-tetrahydropyrazolo[1,5-a][1,3,5]triazine-8-carboxylate
Chemical Structure Depiction of
methyl 3-[2-(4-ethoxyphenyl)ethyl]-1,2,3,4-tetrahydropyrazolo[1,5-a][1,3,5]triazine-8-carboxylate
methyl 3-[2-(4-ethoxyphenyl)ethyl]-1,2,3,4-tetrahydropyrazolo[1,5-a][1,3,5]triazine-8-carboxylate
Compound characteristics
| Compound ID: | C612-1254 |
| Compound Name: | methyl 3-[2-(4-ethoxyphenyl)ethyl]-1,2,3,4-tetrahydropyrazolo[1,5-a][1,3,5]triazine-8-carboxylate |
| Molecular Weight: | 330.38 |
| Molecular Formula: | C17 H22 N4 O3 |
| Smiles: | CCOc1ccc(CCN2CNc3c(cnn3C2)C(=O)OC)cc1 |
| Stereo: | ACHIRAL |
| logP: | 2.4521 |
| logD: | 2.4449 |
| logSw: | -2.6784 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.908 |
| InChI Key: | UDHCXCLIDYZCIW-UHFFFAOYSA-N |