2-(4-chlorophenyl)-4,7-dimethoxy-1H-indole
Basic information
- CAS
61547-05-5- Standard SMILES
COc1ccc(OC)c2[nH]c(-c3ccc(Cl)cc3)cc12- InChIKey
GMJWQXYTCKUTIO-UHFFFAOYSA-N- Molecular formula
- C16H14ClNO2
- Average molar mass
- 287.74 g/mol
- Monoisotopic mass
- 287.0713064
Names & identifiers
- Preferred name
- 2-(4-chlorophenyl)-4,7-dimethoxy-1H-indole
- IUPAC
- 2-(4-chlorophenyl)-4,7-dimethoxy-1H-indole
Names & synonyms
61547-05-52-(4-chlorophenyl)-4,7-dimethoxy-1H-indoleNSC234018DTXSID80310891NSC-234018
Database identifiers
- CAS
61547-05-5- PubChem CID
- 314679
- DTXSID
DTXSID80310891
Properties
Computed structural properties
- XLogP
- 4.3
- Topological polar surface area
- 34.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 320
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Compound notes
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