Basic information
- Standard SMILES
COc1c(C(O)CCc2ccc(Cl)c(Cl)c2)c(OCCN(C)C)c(OC)c2occc12- InChIKey
BYZKPFMASWLGFG-UHFFFAOYSA-N- Molecular formula
- C23H27Cl2NO5
- Average molar mass
- 468.4 g/mol
- Monoisotopic mass
- 467.1266283
Names & identifiers
- Preferred name
- 3-(3,4-Dichlorophenyl)-1-[6-[2-(dimethylamino)ethoxy]-4,7-dimethoxy-1-benzofuran-5-yl]propan-1-ol
- IUPAC
- 3-(3,4-dichlorophenyl)-1-[6-[2-(dimethylamino)ethoxy]-4,7-dimethoxy-1-benzofuran-5-yl]propan-1-ol
Names & synonyms
DTXSID2013843123-(3,4-dichlorophenyl)-1-[6-[2-(dimethylamino)ethoxy]-4,7-dimethoxy-1-benzofuran-5-yl]propan-1-ol
Database identifiers
- PubChem CID
- 38592
- DTXSID
DTXSID201384312
Properties
Computed structural properties
- XLogP
- 5
- Topological polar surface area
- 64.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 10
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 542
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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