methyl 7-(2-methoxy-2-oxoethyl)-2-phenyl[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate
Chemical Structure Depiction of
methyl 7-(2-methoxy-2-oxoethyl)-2-phenyl[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate
methyl 7-(2-methoxy-2-oxoethyl)-2-phenyl[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate
Compound characteristics
| Compound ID: | Y021-1328 |
| Compound Name: | methyl 7-(2-methoxy-2-oxoethyl)-2-phenyl[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate |
| Molecular Weight: | 326.31 |
| Molecular Formula: | C16 H14 N4 O4 |
| Smiles: | COC(Cc1c(cnc2nc(c3ccccc3)nn12)C(=O)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 1.6685 |
| logD: | 1.6684 |
| logSw: | -2.1653 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 72.312 |
| InChI Key: | OVCZUEXQQJKASC-UHFFFAOYSA-N |