2H-Quinolizine-1-methanamine, octahydro-N-(4-((4-methoxyphenyl)azo)-5,6,7,8-tetrahydro-1-naphthalenyl)-, (1R-trans)-
Basic information
- CAS
150359-18-5- Standard SMILES
COc1ccc(N=Nc2ccc(NC[C@@H]3CCCN4CCCC[C@H]34)c3c2CCCC3)cc1- InChIKey
ICLDASHBEVULCK-CCLHPLFOSA-N- Molecular formula
- C27H36N4O
- Average molar mass
- 432.6 g/mol
- Monoisotopic mass
- 432.28891178
Names & identifiers
- Preferred name
- 2H-Quinolizine-1-methanamine, octahydro-N-(4-((4-methoxyphenyl)azo)-5,6,7,8-tetrahydro-1-naphthalenyl)-, (1R-trans)-
- IUPAC
- N-[[(1S,9aR)-2,3,4,6,7,8,9,9a-octahydro-1H-quinolizin-1-yl]methyl]-4-[(4-methoxyphenyl)diazenyl]-5,6,7,8-tetrahydronaphthalen-1-amine
Names & synonyms
150359-18-52H-Quinolizine-1-methanamine, octahydro-N-(4-((4-methoxyphenyl)azo)-5,6,7,8-tetrahydro-1-naphthalenyl)-, (1R-trans)-2H-Quinolizine-1-methanamine, octahydro-N-[4-[(4-methoxyphenyl)azo]-5,6,7,8-tetrahydro-1-naphthalenyl]-, (1R-trans)-N-[[(1S,9aR)-2,3,4,6,7,8,9,9a-octahydro-1H-quinolizin-1-yl]methyl]-8-[(E)-(4-methoxyphenyl)azo]tetralin-5-amine
Database identifiers
- CAS
150359-18-5- PubChem CID
- 457565
Properties
Computed structural properties
- XLogP
- 6.7
- Topological polar surface area
- 49.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 6
- Heavy atoms
- 32
- Formal charge
- 0
- Complexity
- 604
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Compound notes
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