5-[(4-phenylpiperazin-1-yl)methyl]-2-{[(thiophen-2-yl)methyl]amino}[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
Chemical Structure Depiction of
5-[(4-phenylpiperazin-1-yl)methyl]-2-{[(thiophen-2-yl)methyl]amino}[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
5-[(4-phenylpiperazin-1-yl)methyl]-2-{[(thiophen-2-yl)methyl]amino}[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
Compound characteristics
| Compound ID: | D412-0565 |
| Compound Name: | 5-[(4-phenylpiperazin-1-yl)methyl]-2-{[(thiophen-2-yl)methyl]amino}[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one |
| Molecular Weight: | 421.52 |
| Molecular Formula: | C21 H23 N7 O S |
| Smiles: | C(c1cccs1)Nc1nc2NC(CN3CCN(CC3)c3ccccc3)=CC(n2n1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.4045 |
| logD: | 2.0387 |
| logSw: | -2.8124 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 70.992 |
| InChI Key: | IFYVOYNAINSGNW-UHFFFAOYSA-N |