N-(2H-1,3-benzodioxol-5-yl)-3-[2-(3,5-dimethoxyphenyl)-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]propanamide
Chemical Structure Depiction of
N-(2H-1,3-benzodioxol-5-yl)-3-[2-(3,5-dimethoxyphenyl)-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]propanamide
N-(2H-1,3-benzodioxol-5-yl)-3-[2-(3,5-dimethoxyphenyl)-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]propanamide
Compound characteristics
| Compound ID: | C561-1810 |
| Compound Name: | N-(2H-1,3-benzodioxol-5-yl)-3-[2-(3,5-dimethoxyphenyl)-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]propanamide |
| Molecular Weight: | 475.5 |
| Molecular Formula: | C25 H25 N5 O5 |
| Smiles: | Cc1c(CCC(Nc2ccc3c(c2)OCO3)=O)c(C)n2c(n1)nc(c1cc(cc(c1)OC)OC)n2 |
| Stereo: | ACHIRAL |
| logP: | 3.5562 |
| logD: | 3.425 |
| logSw: | -3.795 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 86.185 |
| InChI Key: | LFDSOSZZUFQBFI-UHFFFAOYSA-N |