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Compound
8-Ethyl-9-hydroxy-6-methyl-4-phenylpyrrolo[3,4-c]carbazole-1,3-dione
HCID
21980644
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Basic information
Standard SMILES
CCc1cc2c(cc1O)c1c3c(c(-c4ccccc4)cc1n2C)C(=O)NC3=O
InChIKey
QDFFNEWNMLGPDJ-UHFFFAOYSA-N
Molecular formula
C23H18N2O3
Average molar mass
370.4 g/mol
Monoisotopic mass
370.13174244
Names & identifiers
Preferred name
8-Ethyl-9-hydroxy-6-methyl-4-phenylpyrrolo[3,4-c]carbazole-1,3-dione
IUPAC
8-ethyl-9-hydroxy-6-methyl-4-phenylpyrrolo[3,4-c]carbazole-1,3-dione
Names & synonyms
SCHEMBL5829215
Database identifiers
PubChem CID
21980644
Properties
Computed structural properties
XLogP
4.2
Topological polar surface area
71.3 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
3
Rotatable bonds
2
Heavy atoms
28
Formal charge
0
Complexity
646
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HRID
159426
As product
Training data from https://doi.org/10.1039/C8SC04228D (9/10)
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