2-Azetidinone, 3-chloro-1-((2,4-dimethylphenyl)methyl)-4-(1H-indol-3-yl)-
Basic information
- CAS
86427-33-0- Standard SMILES
Cc1ccc(CN2C(=O)C(Cl)C2c2c[nH]c3ccccc23)c(C)c1- InChIKey
LEKVMFOKVJJYHK-UHFFFAOYSA-N- Molecular formula
- C20H19ClN2O
- Average molar mass
- 338.8 g/mol
- Monoisotopic mass
- 338.1185909
Names & identifiers
- Preferred name
- 2-Azetidinone, 3-chloro-1-((2,4-dimethylphenyl)methyl)-4-(1H-indol-3-yl)-
- IUPAC
- 3-chloro-1-[(2,4-dimethylphenyl)methyl]-4-(1H-indol-3-yl)azetidin-2-one
Names & synonyms
BRN 45414963-Chloro-1-((2,4-dimethylphenyl)methyl)-4-(1H-indol-3-yl)-2-azetidinone86427-33-02-AZETIDINONE, 3-CHLORO-1-((2,4-DIMETHYLPHENYL)METHYL)-4-(1H-INDOL-3-YL)-RefChem:2561813-chloro-1-[(2,4-dimethylphenyl)methyl]-4-(1H-indol-3-yl)azetidin-2-oneDTXSID001006829
Database identifiers
- CAS
86427-33-0- PubChem CID
- 55494
- DTXSID
DTXSID001006829
Properties
Computed structural properties
- XLogP
- 4
- Topological polar surface area
- 36.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 3
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 484
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Compound notes
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