1,1'-[1-benzyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-diyl]di(butan-1-one)
Chemical Structure Depiction of
1,1'-[1-benzyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-diyl]di(butan-1-one)
1,1'-[1-benzyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-diyl]di(butan-1-one)
Compound characteristics
| Compound ID: | 8005-9978 |
| Compound Name: | 1,1'-[1-benzyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-diyl]di(butan-1-one) |
| Molecular Weight: | 432.52 |
| Molecular Formula: | C26 H28 N2 O4 |
| Smiles: | CCCC(C1=CN(Cc2ccccc2)C=C(C1c1cccc(c1)[N+]([O-])=O)C(CCC)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.3257 |
| logD: | 5.3257 |
| logSw: | -5.3648 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 62.804 |
| InChI Key: | MHYIMRXKELKIOV-UHFFFAOYSA-N |