3-[2-(2,4-dichlorophenyl)-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]-N-[(oxolan-2-yl)methyl]propanamide
Chemical Structure Depiction of
3-[2-(2,4-dichlorophenyl)-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]-N-[(oxolan-2-yl)methyl]propanamide
3-[2-(2,4-dichlorophenyl)-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]-N-[(oxolan-2-yl)methyl]propanamide
Compound characteristics
| Compound ID: | C999-0736 |
| Compound Name: | 3-[2-(2,4-dichlorophenyl)-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]-N-[(oxolan-2-yl)methyl]propanamide |
| Molecular Weight: | 448.35 |
| Molecular Formula: | C21 H23 Cl2 N5 O2 |
| Smiles: | Cc1c(CCC(NCC2CCCO2)=O)c(C)n2c(n1)nc(c1ccc(cc1[Cl])[Cl])n2 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.8638 |
| logD: | 2.8636 |
| logSw: | -3.7068 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.959 |
| InChI Key: | LBFNHSXVBBVFBG-OAHLLOKOSA-N |