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N-(2-(5-chloro-1H-indol-3-yl)ethyl)-3',4'-dimethylbiphenyl-3-carboxamide

HCID 67973302
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Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
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Basic information

Standard SMILES
Cc1ccc(-c2cccc(C(=O)NCCc3c[nH]c4ccc(Cl)cc34)c2)cc1C
InChIKey
JZFLDJOIQGROKB-UHFFFAOYSA-N
Molecular formula
C25H23ClN2O
Average molar mass
402.9 g/mol
Monoisotopic mass
402.1498911

Names & identifiers

Preferred name
N-(2-(5-chloro-1H-indol-3-yl)ethyl)-3',4'-dimethylbiphenyl-3-carboxamide
IUPAC
N-[2-(5-chloro-1H-indol-3-yl)ethyl]-3-(3,4-dimethylphenyl)benzamide

Names & synonyms

SCHEMBL9936230JZFLDJOIQGROKB-UHFFFAOYSA-NN-(2-(5-chloro-1H-indol-3-yl)ethyl)-3',4'-dimethylbiphenyl-3-carboxamide

Database identifiers

PubChem CID
67973302

Properties

Computed structural propertiesFilling in

XLogP
6.3
Topological polar surface area
44.9 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
1
Rotatable bonds
5
Heavy atoms
29
Formal charge
0
Complexity
555

Related reactions

1 records
New reaction record
HRID 925386 reaction equation
HRID 925386As productuspto-grants-2016_03

Compound notes

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