2-[4-({5-[(2'-cyano[1,1'-biphenyl]-4-yl)methoxy]-4-oxo-4H-pyran-2-yl}methyl)piperazin-1-yl]-2-oxoethyl acetate
Chemical Structure Depiction of
2-[4-({5-[(2'-cyano[1,1'-biphenyl]-4-yl)methoxy]-4-oxo-4H-pyran-2-yl}methyl)piperazin-1-yl]-2-oxoethyl acetate
2-[4-({5-[(2'-cyano[1,1'-biphenyl]-4-yl)methoxy]-4-oxo-4H-pyran-2-yl}methyl)piperazin-1-yl]-2-oxoethyl acetate
Compound characteristics
| Compound ID: | V007-1477 |
| Compound Name: | 2-[4-({5-[(2'-cyano[1,1'-biphenyl]-4-yl)methoxy]-4-oxo-4H-pyran-2-yl}methyl)piperazin-1-yl]-2-oxoethyl acetate |
| Molecular Weight: | 501.54 |
| Molecular Formula: | C28 H27 N3 O6 |
| Salt: | not_available |
| Smiles: | CC(=O)OCC(N1CCN(CC1)CC1=CC(C(=CO1)OCc1ccc(cc1)c1ccccc1C#N)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.6623 |
| logD: | 1.6617 |
| logSw: | -2.4963 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 88.099 |
| InChI Key: | OTTBHSGKWGFDBV-UHFFFAOYSA-N |