N-[(2H-1,3-benzodioxol-5-yl)methyl]-3-(7-hydroxy-5-methyl[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)propanamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-3-(7-hydroxy-5-methyl[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)propanamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-3-(7-hydroxy-5-methyl[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)propanamide
Compound characteristics
| Compound ID: | C561-2506 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-3-(7-hydroxy-5-methyl[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)propanamide |
| Molecular Weight: | 355.35 |
| Molecular Formula: | C17 H17 N5 O4 |
| Smiles: | Cc1c(CCC(NCc2ccc3c(c2)OCO3)=O)c(n2c(ncn2)n1)O |
| Stereo: | ACHIRAL |
| logP: | 0.5152 |
| logD: | -0.9864 |
| logSw: | -1.9343 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 89.064 |
| InChI Key: | PECGEKKGNVDOJP-UHFFFAOYSA-N |