2-(4-tert-butylphenyl)-5-[(3-methoxyanilino)methyl][1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
Chemical Structure Depiction of
2-(4-tert-butylphenyl)-5-[(3-methoxyanilino)methyl][1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
2-(4-tert-butylphenyl)-5-[(3-methoxyanilino)methyl][1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
Compound characteristics
| Compound ID: | D351-0319 |
| Compound Name: | 2-(4-tert-butylphenyl)-5-[(3-methoxyanilino)methyl][1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one |
| Molecular Weight: | 403.48 |
| Molecular Formula: | C23 H25 N5 O2 |
| Smiles: | CC(C)(C)c1ccc(cc1)c1nc2NC(CNc3cccc(c3)OC)=CC(n2n1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.0033 |
| logD: | 4.8002 |
| logSw: | -4.7106 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 69.119 |
| InChI Key: | YFRWDNNNLVJDBJ-UHFFFAOYSA-N |