1,1'-[1-benzyl-4-(2-nitrophenyl)-1,4-dihydropyridine-3,5-diyl]di(octan-1-one)
Chemical Structure Depiction of
1,1'-[1-benzyl-4-(2-nitrophenyl)-1,4-dihydropyridine-3,5-diyl]di(octan-1-one)
1,1'-[1-benzyl-4-(2-nitrophenyl)-1,4-dihydropyridine-3,5-diyl]di(octan-1-one)
Compound characteristics
| Compound ID: | 1630-0041 |
| Compound Name: | 1,1'-[1-benzyl-4-(2-nitrophenyl)-1,4-dihydropyridine-3,5-diyl]di(octan-1-one) |
| Molecular Weight: | 544.74 |
| Molecular Formula: | C34 H44 N2 O4 |
| Smiles: | CCCCCCCC(C1=CN(Cc2ccccc2)C=C(C1c1ccccc1[N+]([O-])=O)C(CCCCCCC)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 9.1698 |
| logD: | 9.1698 |
| logSw: | -5.802 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 62.504 |
| InChI Key: | ZDXGUANOBCXFSY-UHFFFAOYSA-N |