methyl 2-[(3,4-diethoxyphenyl)methyl]-9-methylthieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine-8-carboxylate
Chemical Structure Depiction of
methyl 2-[(3,4-diethoxyphenyl)methyl]-9-methylthieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine-8-carboxylate
methyl 2-[(3,4-diethoxyphenyl)methyl]-9-methylthieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine-8-carboxylate
Compound characteristics
| Compound ID: | Y502-3048 |
| Compound Name: | methyl 2-[(3,4-diethoxyphenyl)methyl]-9-methylthieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine-8-carboxylate |
| Molecular Weight: | 426.49 |
| Molecular Formula: | C21 H22 N4 O4 S |
| Smiles: | CCOc1ccc(Cc2nc3c4c(C)c(C(=O)OC)sc4ncn3n2)cc1OCC |
| Stereo: | ACHIRAL |
| logP: | 3.3905 |
| logD: | 3.3894 |
| logSw: | -3.9087 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 67.704 |
| InChI Key: | DVBCRXUBTJBTLS-UHFFFAOYSA-N |