4'-({[4-oxo-6-({4-[3-(trifluoromethyl)benzoyl]piperazin-1-yl}methyl)-4H-pyran-3-yl]oxy}methyl)[1,1'-biphenyl]-2-carbonitrile
Chemical Structure Depiction of
4'-({[4-oxo-6-({4-[3-(trifluoromethyl)benzoyl]piperazin-1-yl}methyl)-4H-pyran-3-yl]oxy}methyl)[1,1'-biphenyl]-2-carbonitrile
4'-({[4-oxo-6-({4-[3-(trifluoromethyl)benzoyl]piperazin-1-yl}methyl)-4H-pyran-3-yl]oxy}methyl)[1,1'-biphenyl]-2-carbonitrile
Compound characteristics
| Compound ID: | V007-2991 |
| Compound Name: | 4'-({[4-oxo-6-({4-[3-(trifluoromethyl)benzoyl]piperazin-1-yl}methyl)-4H-pyran-3-yl]oxy}methyl)[1,1'-biphenyl]-2-carbonitrile |
| Molecular Weight: | 573.57 |
| Molecular Formula: | C32 H26 F3 N3 O4 |
| Salt: | not_available |
| Smiles: | C1CN(CCN1CC1=CC(C(=CO1)OCc1ccc(cc1)c1ccccc1C#N)=O)C(c1cccc(c1)C(F)(F)F)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1435 |
| logD: | 4.1431 |
| logSw: | -4.4842 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 67.124 |
| InChI Key: | HGCGWBVOLGYYIS-UHFFFAOYSA-N |