methyl 7-(4-methoxyphenyl)-6-oxo-2-(thiophen-2-yl)-6,7-dihydropyrido[3,4-e][1,2,4]triazolo[1,5-a]pyrimidine-9-carboxylate
Chemical Structure Depiction of
methyl 7-(4-methoxyphenyl)-6-oxo-2-(thiophen-2-yl)-6,7-dihydropyrido[3,4-e][1,2,4]triazolo[1,5-a]pyrimidine-9-carboxylate
methyl 7-(4-methoxyphenyl)-6-oxo-2-(thiophen-2-yl)-6,7-dihydropyrido[3,4-e][1,2,4]triazolo[1,5-a]pyrimidine-9-carboxylate
Compound characteristics
| Compound ID: | Y021-2499 |
| Compound Name: | methyl 7-(4-methoxyphenyl)-6-oxo-2-(thiophen-2-yl)-6,7-dihydropyrido[3,4-e][1,2,4]triazolo[1,5-a]pyrimidine-9-carboxylate |
| Molecular Weight: | 433.44 |
| Molecular Formula: | C21 H15 N5 O4 S |
| Smiles: | COC(C1=CN(C(C2C=Nc3nc(c4cccs4)nn3C1=2)=O)c1ccc(cc1)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 2.6248 |
| logD: | 2.6248 |
| logSw: | -2.8904 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 80.17 |
| InChI Key: | ITZUDCZYUZRPFQ-UHFFFAOYSA-N |