Rac-6-chloro-3-(3-chloro-benzyl)-3-(3,5-dimethoxy-phenyl)-1,3-dihydro-indol-2-one
Basic information
- Standard SMILES
COc1cc(OC)cc(C2(Cc3cccc(Cl)c3)C(=O)Nc3cc(Cl)ccc32)c1- InChIKey
PWVRXWWZNUQVDD-UHFFFAOYSA-N- Molecular formula
- C23H19Cl2NO3
- Average molar mass
- 428.3 g/mol
- Monoisotopic mass
- 427.0741989
Names & identifiers
- Preferred name
- Rac-6-chloro-3-(3-chloro-benzyl)-3-(3,5-dimethoxy-phenyl)-1,3-dihydro-indol-2-one
- IUPAC
- 6-chloro-3-[(3-chlorophenyl)methyl]-3-(3,5-dimethoxyphenyl)-1H-indol-2-one
Names & synonyms
SCHEMBL3969641PWVRXWWZNUQVDD-UHFFFAOYSA-Nrac-6-chloro-3-(3-chloro-benzyl)-3-(3,5-dimethoxy-phenyl)-1,3-dihydro-indol-2-one
Database identifiers
- PubChem CID
- 11998413
Properties
Computed structural properties
- XLogP
- 5.4
- Topological polar surface area
- 47.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 578
Related reactions
1 records
Compound notes
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