3-[2-(2,4-dichlorophenyl)-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]-N-[3-(2-oxopyrrolidin-1-yl)propyl]propanamide
Chemical Structure Depiction of
3-[2-(2,4-dichlorophenyl)-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]-N-[3-(2-oxopyrrolidin-1-yl)propyl]propanamide
3-[2-(2,4-dichlorophenyl)-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]-N-[3-(2-oxopyrrolidin-1-yl)propyl]propanamide
Compound characteristics
| Compound ID: | C561-2235 |
| Compound Name: | 3-[2-(2,4-dichlorophenyl)-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]-N-[3-(2-oxopyrrolidin-1-yl)propyl]propanamide |
| Molecular Weight: | 489.4 |
| Molecular Formula: | C23 H26 Cl2 N6 O2 |
| Smiles: | Cc1c(CCC(NCCCN2CCCC2=O)=O)c(C)n2c(n1)nc(c1ccc(cc1[Cl])[Cl])n2 |
| Stereo: | ACHIRAL |
| logP: | 2.0733 |
| logD: | 2.0731 |
| logSw: | -3.3796 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.658 |
| InChI Key: | STYWNYZSJXVERZ-UHFFFAOYSA-N |