dimethyl 5-[3-(5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)propanamido]benzene-1,3-dicarboxylate
Chemical Structure Depiction of
dimethyl 5-[3-(5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)propanamido]benzene-1,3-dicarboxylate
dimethyl 5-[3-(5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)propanamido]benzene-1,3-dicarboxylate
Compound characteristics
| Compound ID: | C561-1639 |
| Compound Name: | dimethyl 5-[3-(5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)propanamido]benzene-1,3-dicarboxylate |
| Molecular Weight: | 411.42 |
| Molecular Formula: | C20 H21 N5 O5 |
| Smiles: | Cc1c(CCC(Nc2cc(cc(c2)C(=O)OC)C(=O)OC)=O)c(C)n2c(ncn2)n1 |
| Stereo: | ACHIRAL |
| logP: | 2.1889 |
| logD: | 2.1886 |
| logSw: | -2.622 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 97.542 |
| InChI Key: | LEAJUJFVBLLMCM-UHFFFAOYSA-N |