[2-[(6,7-Dimethoxyisoquinolin-1-yl)methyl]-4,5-dimethoxyphenyl]methanol
Basic information
- CAS
18017-47-5- Standard SMILES
COc1cc(CO)c(Cc2nccc3cc(OC)c(OC)cc23)cc1OC- InChIKey
YQAGLEABWKZDJX-UHFFFAOYSA-N- Molecular formula
- C21H23NO5
- Average molar mass
- 369.4 g/mol
- Monoisotopic mass
- 369.15762283
Names & identifiers
- Preferred name
- [2-[(6,7-Dimethoxyisoquinolin-1-yl)methyl]-4,5-dimethoxyphenyl]methanol
- IUPAC
- [2-[(6,7-dimethoxyisoquinolin-1-yl)methyl]-4,5-dimethoxyphenyl]methanol
Names & synonyms
18017-47-5[2-[(6,7-dimethoxyisoquinolin-1-yl)methyl]-4,5-dimethoxyphenyl]methanol{2-[(6,7-Dimethoxyisoquinolin-1-yl)methyl]-4,5-dimethoxyphenyl}methanolNSC279526DTXSID30313998NSC-279526[2-[(6,7-dimethoxy-1-isoquinolyl)methyl]-4,5-dimethoxy-phenyl]methanolIsoquinolinium, 1-[[2-(hydroxymethyl)-4,5-dimethoxyphenyl]methyl]-6,7-dimethoxy-
Database identifiers
- CAS
18017-47-5- PubChem CID
- 322370
- DTXSID
DTXSID30313998
Properties
Computed structural properties
- XLogP
- 3.1
- Topological polar surface area
- 70 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 7
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 450
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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