Basic information
- CAS
53924-11-1- Standard SMILES
COc1ccccc1C(c1ccccc1)c1c[nH]c2ccc(C(=O)O)cc12- InChIKey
PACZNPVFFGBOPX-UHFFFAOYSA-N- Molecular formula
- C23H19NO3
- Average molar mass
- 357.4 g/mol
- Monoisotopic mass
- 357.13649347
Names & identifiers
- Preferred name
- 3-((2-Methoxyphenyl)phenylmethyl)-1H-indole-5-carboxylic acid
- IUPAC
- 3-[(2-methoxyphenyl)-phenylmethyl]-1H-indole-5-carboxylic acid
Names & synonyms
3-((2-Methoxyphenyl)phenylmethyl)-1H-indole-5-carboxylic acid53924-11-1BRN 04444661H-INDOLE-5-CARBOXYLIC ACID, 3-((2-METHOXYPHENYL)PHENYLMETHYL)-DTXSID009687123-[(2-Methoxyphenyl)(phenyl)methyl]-1H-indole-5-carboxylic acid
Database identifiers
- CAS
53924-11-1- PubChem CID
- 40930
- DTXSID
DTXSID00968712
Properties
Computed structural properties
- XLogP
- 4.9
- Topological polar surface area
- 62.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 504
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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