methyl N-[3-(5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)propanoyl]valinate
Chemical Structure Depiction of
methyl N-[3-(5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)propanoyl]valinate
methyl N-[3-(5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)propanoyl]valinate
Compound characteristics
| Compound ID: | C561-1718 |
| Compound Name: | methyl N-[3-(5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)propanoyl]valinate |
| Molecular Weight: | 333.39 |
| Molecular Formula: | C16 H23 N5 O3 |
| Smiles: | CC(C)C(C(=O)OC)NC(CCc1c(C)nc2ncnn2c1C)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.0774 |
| logD: | 1.0771 |
| logSw: | -1.7206 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 77.314 |
| InChI Key: | SZBSYZDTQNXFBX-AWEZNQCLSA-N |