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9-Amino-4-(2-chlorophenyl)-6-methylpyrrolo[3,4-c]carbazole-1,3-dione (HCID 21980421)|Huagongshe
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Compound
9-Amino-4-(2-chlorophenyl)-6-methylpyrrolo[3,4-c]carbazole-1,3-dione
HCID
21980421
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Notes
Reactions
Basic information
Names & identifiers
Properties
Related reactions
Compound notes
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Basic information
Standard SMILES
Cn1c2ccc(N)cc2c2c3c(c(-c4ccccc4Cl)cc21)C(=O)NC3=O
InChIKey
DFLOFBGVBVPTKY-UHFFFAOYSA-N
Molecular formula
C21H14ClN3O2
Average molar mass
375.8 g/mol
Names & identifiers
Preferred name
9-Amino-4-(2-chlorophenyl)-6-methylpyrrolo[3,4-c]carbazole-1,3-dione
IUPAC
9-amino-4-(2-chlorophenyl)-6-methylpyrrolo[3,4-c]carbazole-1,3-dione
Names & synonyms
SCHEMBL5828569
Database identifiers
PubChem CID
21980421
Properties
Computed structural properties
XLogP
3.7
Topological polar surface area
77.1 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
3
Rotatable bonds
1
Heavy atoms
27
Formal charge
0
Complexity
643
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Related reactions
4 records
New reaction record
All
As reactant
As product
As reagent
As catalyst
As solvent
HRID
157385
As reactant
Training data from https://doi.org/10.1039/C8SC04228D (9/10)
HRID
171819
As product
Training data from https://doi.org/10.1039/C8SC04228D (9/10)
HRID
1554489
As reactant
Training data from https://doi.org/10.1039/C8SC04228D (1/10)
HRID
2332243
As reactant
Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Compound notes
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