2-(4-tert-butylphenyl)-5-[(4-methylpiperazin-1-yl)methyl][1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
Chemical Structure Depiction of
2-(4-tert-butylphenyl)-5-[(4-methylpiperazin-1-yl)methyl][1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
2-(4-tert-butylphenyl)-5-[(4-methylpiperazin-1-yl)methyl][1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
Compound characteristics
| Compound ID: | D351-0285 |
| Compound Name: | 2-(4-tert-butylphenyl)-5-[(4-methylpiperazin-1-yl)methyl][1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one |
| Molecular Weight: | 416.95 |
| Molecular Formula: | C21 H28 N6 O |
| Salt: | HCl |
| Smiles: | CC(C)(C)c1ccc(cc1)c1nc2NC(CN3CCN(C)CC3)=CC(n2n1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9892 |
| logD: | 2.0412 |
| logSw: | -3.1992 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.55 |
| InChI Key: | HZIZCGUPNAKMCR-UHFFFAOYSA-N |