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7-acetyl-12-[4-(1-phenyl-1H-benzo[d]imidazol-2-yl)phenyl]-7H-dibenzo [a,g]carbazole

HCID 71278259
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
CC(=O)n1c2ccc3ccccc3c2c2cc(-c3ccc(-c4nc5ccccc5n4-c4ccccc4)cc3)c3ccccc3c21
InChIKey
VFMRJPIVTBPVHU-UHFFFAOYSA-N
Molecular formula
C41H27N3O
Average molar mass
577.7 g/mol

Names & identifiers

Preferred name
7-acetyl-12-[4-(1-phenyl-1H-benzo[d]imidazol-2-yl)phenyl]-7H-dibenzo [a,g]carbazole
IUPAC
1-[20-[4-(1-phenylbenzimidazol-2-yl)phenyl]-12-azapentacyclo[11.8.0.02,11.03,8.014,19]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaen-12-yl]ethanone

Names & synonyms

SCHEMBL14734530VFMRJPIVTBPVHU-UHFFFAOYSA-N7-acetyl-12-[4-(1-phenyl-1H-benzo[d]imidazol-2-yl)phenyl]-7H-dibenzo [a,g]carbazole

Database identifiers

PubChem CID
71278259

Properties

Computed structural properties

XLogP
10.2
Topological polar surface area
39.8 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
2
Rotatable bonds
3
Heavy atoms
45
Formal charge
0
Complexity
1,050

Related reactions

1 records
New reaction record
HRID 530765 reaction equation
HRID 530765As productuspto-grants-2016_05

Compound notes

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On this pageBasic informationNames & identifiersPropertiesRelated reactionsCompound notes