1-Benzhydryl-5-bromo-1H-indole-2-carboxylic Acid

HCID 22988239
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Basic information

Standard SMILES
O=C(O)c1cc2cc(Br)ccc2n1C(c1ccccc1)c1ccccc1
InChIKey
KRNPKCSYCMJBTQ-UHFFFAOYSA-N
Molecular formula
C22H16BrNO2
Average molar mass
406.3 g/mol

Names & identifiers

Preferred name
1-Benzhydryl-5-bromo-1H-indole-2-carboxylic Acid
IUPAC
1-benzhydryl-5-bromoindole-2-carboxylic acid

Names & synonyms

SCHEMBL7239492KRNPKCSYCMJBTQ-UHFFFAOYSA-N1-Benzhydryl-5-bromo-1H-indole-2-carboxylic Acid

Database identifiers

PubChem CID
22988239

Properties

Computed structural properties

XLogP
5.8
Topological polar surface area
42.2 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
2
Rotatable bonds
4
Heavy atoms
26

Related reactions

6 records
New reaction record

Compound notes

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