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1-Hydroxy-7,9-diazatetracyclo[7.7.0.02,7.011,16]hexadeca-3,11,13,15-tetraen-10-one

HCID 338744
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Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
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Basic information

CAS
74066-72-1
Standard SMILES
O=C1c2ccccc2C2(O)C3C=CCCN3CN12
InChIKey
OSQAWCCKDZKLOP-UHFFFAOYSA-N
Molecular formula
C14H14N2O2
Average molar mass
242.27 g/mol
Monoisotopic mass
242.10552769

Names & identifiers

Preferred name
1-Hydroxy-7,9-diazatetracyclo[7.7.0.02,7.011,16]hexadeca-3,11,13,15-tetraen-10-one
IUPAC
1-hydroxy-7,9-diazatetracyclo[7.7.0.02,7.011,16]hexadeca-3,11,13,15-tetraen-10-one

Names & synonyms

NSC36264974066-72-1DTXSID60320635NSC-36264912b-Hydroxy-3,4,12b,12c-tetrahydro-6H,8H-pyrido[1',2':3,4]imidazo[5,1-a]isoindol-8-one

Database identifiers

CAS
74066-72-1
PubChem CID
338744
DTXSID
DTXSID60320635

Properties

Computed structural properties

XLogP
0.9
Topological polar surface area
43.8 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
3
Rotatable bonds
0
Heavy atoms
18
Formal charge
0
Complexity
422

Related reactions

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Compound notes

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