4'-({[4-oxo-6-({4-[(thiophen-2-yl)acetyl]piperazin-1-yl}methyl)-4H-pyran-3-yl]oxy}methyl)[1,1'-biphenyl]-2-carbonitrile
Chemical Structure Depiction of
4'-({[4-oxo-6-({4-[(thiophen-2-yl)acetyl]piperazin-1-yl}methyl)-4H-pyran-3-yl]oxy}methyl)[1,1'-biphenyl]-2-carbonitrile
4'-({[4-oxo-6-({4-[(thiophen-2-yl)acetyl]piperazin-1-yl}methyl)-4H-pyran-3-yl]oxy}methyl)[1,1'-biphenyl]-2-carbonitrile
Compound characteristics
| Compound ID: | V007-9239 |
| Compound Name: | 4'-({[4-oxo-6-({4-[(thiophen-2-yl)acetyl]piperazin-1-yl}methyl)-4H-pyran-3-yl]oxy}methyl)[1,1'-biphenyl]-2-carbonitrile |
| Molecular Weight: | 525.63 |
| Molecular Formula: | C30 H27 N3 O4 S |
| Salt: | not_available |
| Smiles: | C(C(N1CCN(CC1)CC1=CC(C(=CO1)OCc1ccc(cc1)c1ccccc1C#N)=O)=O)c1cccs1 |
| Stereo: | ACHIRAL |
| logP: | 3.2546 |
| logD: | 3.2539 |
| logSw: | -3.6122 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 67.615 |
| InChI Key: | GEOPLJZWFYXKOO-UHFFFAOYSA-N |