2-(6-benzyl-5-methyl-7-oxo-2-phenyl[1,2,4]triazolo[1,5-a]pyrimidin-4(7H)-yl)-N-butylacetamide
Chemical Structure Depiction of
2-(6-benzyl-5-methyl-7-oxo-2-phenyl[1,2,4]triazolo[1,5-a]pyrimidin-4(7H)-yl)-N-butylacetamide
2-(6-benzyl-5-methyl-7-oxo-2-phenyl[1,2,4]triazolo[1,5-a]pyrimidin-4(7H)-yl)-N-butylacetamide
Compound characteristics
| Compound ID: | D584-4001 |
| Compound Name: | 2-(6-benzyl-5-methyl-7-oxo-2-phenyl[1,2,4]triazolo[1,5-a]pyrimidin-4(7H)-yl)-N-butylacetamide |
| Molecular Weight: | 429.52 |
| Molecular Formula: | C25 H27 N5 O2 |
| Smiles: | [H]C([H])(C1=C(C)N(CC(NCCCC)=O)c2nc(c3ccccc3)nn2C1=O)c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 4.2609 |
| logD: | 4.2609 |
| logSw: | -4.1198 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.796 |
| InChI Key: | VXVDXHRGOMQGRZ-UHFFFAOYSA-N |