Basic information
- CAS
35811-64-4- Standard SMILES
Cc1c(C(=O)c2ccc(F)cc2)c2ccc(Cl)cc2n1C(C)C(=O)O- InChIKey
SAPVNWINMSBGTE-UHFFFAOYSA-N- Molecular formula
- C19H15ClFNO3
- Average molar mass
- 359.8 g/mol
- Monoisotopic mass
- 359.0724492
Names & identifiers
- Preferred name
- 1H-Indole-1-acetic acid, 6-chloro-3-(4-fluorobenzoyl)-alpha,2-methyl-
- IUPAC
- 2-[6-chloro-3-(4-fluorobenzoyl)-2-methylindol-1-yl]propanoic acid
Names & synonyms
RU 4932BRN 150616635811-64-41H-Indole-1-acetic acid, 6-chloro-3-(4-fluorobenzoyl)-alpha,2-methyl-6-Chloro-3-(4-fluorobenzoyl)-alpha,2-dimethyl-1H-indole-1-acetic acidRefChem:2388732-[6-chloro-3-(4-fluorobenzoyl)-2-methyl-1h-indol-1-yl]propanoic acidDTXSID40957206
Database identifiers
- CAS
35811-64-4- PubChem CID
- 215536
- DTXSID
DTXSID40957206
Properties
Computed structural properties
- XLogP
- 4.6
- Topological polar surface area
- 59.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 523
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…