4'-{[(4-oxo-6-{[4-(undec-10-enoyl)piperazin-1-yl]methyl}-4H-pyran-3-yl)oxy]methyl}[1,1'-biphenyl]-2-carbonitrile
Chemical Structure Depiction of
4'-{[(4-oxo-6-{[4-(undec-10-enoyl)piperazin-1-yl]methyl}-4H-pyran-3-yl)oxy]methyl}[1,1'-biphenyl]-2-carbonitrile
4'-{[(4-oxo-6-{[4-(undec-10-enoyl)piperazin-1-yl]methyl}-4H-pyran-3-yl)oxy]methyl}[1,1'-biphenyl]-2-carbonitrile
Compound characteristics
| Compound ID: | V006-3933 |
| Compound Name: | 4'-{[(4-oxo-6-{[4-(undec-10-enoyl)piperazin-1-yl]methyl}-4H-pyran-3-yl)oxy]methyl}[1,1'-biphenyl]-2-carbonitrile |
| Molecular Weight: | 567.73 |
| Molecular Formula: | C35 H41 N3 O4 |
| Salt: | not_available |
| Smiles: | C=CCCCCCCCCC(N1CCN(CC1)CC1=CC(C(=CO1)OCc1ccc(cc1)c1ccccc1C#N)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.0988 |
| logD: | 6.098 |
| logSw: | -5.7903 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 66.868 |
| InChI Key: | LTXOGPHKTVXUDM-UHFFFAOYSA-N |