RefChem:1073418
(E)-but-2-enedioic acid;2-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)-7-azatricyclo[9.4.0.03,8]pentadeca-1(15),3(8),4,6,11,13-hexaene
Also Known As: 10,11-Dihydro-5-(3-alpha-tropanyl)-5H-benzo(4,5)cyclohepta(1,2-b)pyridine hydrogen maleate|5H-Benzo(4,5)cyclohepta(1,2-b)pyridine, 10,11-dihydro-5-(3-alpha-tropanyl)-, hydrogen maleate|5H-Benzo[4,5]cyclohepta[1,2-b]pyridine, 10,11-dihydro-5-(8-methyl-8-azabicyclo[3.2.1]oct-3-yl)-, endo-, (Z)-2-butenedioate (1:1)
| Molecular Formula | C26H30N2O4 |
|---|---|
| Molecular Weight | 434.22055 g/mol |
| LogP | 3.8967 |
| Topological Polar Surface Area | 90.73 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 434.22055 |
| Monoisotopic Mass | 434.22055 |
| Heavy Atoms | 32 |
| Complexity | 940.8914 |
Chemical Identifiers
| CAS Number | 73698-56-3 |
|---|---|
| SMILES | CN1C2CCC1CC(C2)C3C4=C(CCC5=CC=CC=C35)N=CC=C4.C(=C/C(=O)O)\C(=O)O |
Product Overview
RefChem:1073418 (CAS 73698-56-3), with molecular formula C26H30N2O4 and molecular weight 434.22055 g/mol. IUPAC: (E)-but-2-enedioic acid;2-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)-7-azatricyclo[9.4.0.03,8]pentadeca-1(15),3(8),4,6,11,13-hexaene.
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