methyl 7-[2-(dimethylamino)ethenyl]-2-phenyl[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate
Chemical Structure Depiction of
methyl 7-[2-(dimethylamino)ethenyl]-2-phenyl[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate
methyl 7-[2-(dimethylamino)ethenyl]-2-phenyl[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate
Compound characteristics
| Compound ID: | Y020-9764 |
| Compound Name: | methyl 7-[2-(dimethylamino)ethenyl]-2-phenyl[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate |
| Molecular Weight: | 323.35 |
| Molecular Formula: | C17 H17 N5 O2 |
| Smiles: | CN(C)/C=C/c1c(cnc2nc(c3ccccc3)nn12)C(=O)OC |
| Stereo: | ACHIRAL |
| logP: | 2.0935 |
| logD: | 2.0822 |
| logSw: | -2.5841 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 55.232 |
| InChI Key: | BUTCJKBWTWPJNL-UHFFFAOYSA-N |