2-[6,7-dimethyl-2-(4-phenylphenyl)-1H-indol-3-yl]acetic Acid
Basic information
- CAS
5095-04-5- Standard SMILES
Cc1ccc2c(CC(=O)O)c(-c3ccc(-c4ccccc4)cc3)[nH]c2c1C- InChIKey
NUCAAJKPEBJNQP-UHFFFAOYSA-N- Molecular formula
- C24H21NO2
- Average molar mass
- 355.4 g/mol
- Monoisotopic mass
- 355.15722891
Names & identifiers
- Preferred name
- 2-[6,7-dimethyl-2-(4-phenylphenyl)-1H-indol-3-yl]acetic Acid
- IUPAC
- 2-[6,7-dimethyl-2-(4-phenylphenyl)-1H-indol-3-yl]acetic acid
Names & synonyms
5095-04-52-[6,7-dimethyl-2-(4-phenylphenyl)-1H-indol-3-yl]acetic AcidDTXSID80409991[2-([1,1'-Biphenyl]-4-yl)-6,7-dimethyl-1H-indol-3-yl]acetic acid
Database identifiers
- CAS
5095-04-5- PubChem CID
- 5207680
- DTXSID
DTXSID80409991
Properties
Computed structural properties
- XLogP
- 5.5
- Topological polar surface area
- 53.1 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 507
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Compound notes
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