ethyl [4-({5-[(2'-cyano[1,1'-biphenyl]-4-yl)methoxy]-4-oxo-4H-pyran-2-yl}methyl)piperazin-1-yl](oxo)acetate
Chemical Structure Depiction of
ethyl [4-({5-[(2'-cyano[1,1'-biphenyl]-4-yl)methoxy]-4-oxo-4H-pyran-2-yl}methyl)piperazin-1-yl](oxo)acetate
ethyl [4-({5-[(2'-cyano[1,1'-biphenyl]-4-yl)methoxy]-4-oxo-4H-pyran-2-yl}methyl)piperazin-1-yl](oxo)acetate
Compound characteristics
| Compound ID: | V009-0253 |
| Compound Name: | ethyl [4-({5-[(2'-cyano[1,1'-biphenyl]-4-yl)methoxy]-4-oxo-4H-pyran-2-yl}methyl)piperazin-1-yl](oxo)acetate |
| Molecular Weight: | 501.54 |
| Molecular Formula: | C28 H27 N3 O6 |
| Salt: | not_available |
| Smiles: | CCOC(C(N1CCN(CC1)CC1=CC(C(=CO1)OCc1ccc(cc1)c1ccccc1C#N)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.4054 |
| logD: | 2.4053 |
| logSw: | -2.7945 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 88.149 |
| InChI Key: | RBVVKLINXIRQKB-UHFFFAOYSA-N |