Basic information
- CAS
73826-62-7- Standard SMILES
O=C(CCCCCCCCC(=O)CC1NCCc2ccccc21)CC1NCCc2ccccc21- InChIKey
ZGKQTNYTTPHDRG-UHFFFAOYSA-N- Molecular formula
- C30H40N2O2
- Average molar mass
- 460.6 g/mol
- Monoisotopic mass
- 460.30897852
Names & identifiers
- Preferred name
- 1,12-Di(1,2,3,4-tetrahydroisoquinolin-1-yl)dodecane-2,11-dione
- IUPAC
- 1,12-bis(1,2,3,4-tetrahydroisoquinolin-1-yl)dodecane-2,11-dione
Names & synonyms
73826-62-7DTXSID909949441,12-Di(1,2,3,4-tetrahydroisoquinolin-1-yl)dodecane-2,11-dioneRefChem:1051849DTXCID101421975Octamethylenedicarbonyldimethylenebis(1,2,3,4-tetrahydroisoquinoline)ISOQUINOLINE, OCTAMETHYLENEDICARBONYLDIMETHYLENEBIS(1,2,3,4-TETRAHYDRO-
Database identifiers
- CAS
73826-62-7- PubChem CID
- 52637
- DTXSID
DTXSID90994944
Properties
Computed structural properties
- XLogP
- 4.6
- Topological polar surface area
- 58.2 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 13
- Heavy atoms
- 34
- Formal charge
- 0
- Complexity
- 581
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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