(1Z)-1-hydrazinylidene-4,4,6,9-tetramethyl-4H-pyrrolo[3,2,1-ij]quinolin-2(1H)-one

HCID 950744

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Basic information

CAS: 524047-01-6
Standard SMILES: CC1=CC(C)(C)n2c(O)c(N=N)c3c(C)ccc1c32
InChIKey: NDWINFPHYMTYQO-UHFFFAOYSA-N
Molecular formula: C15H17N3O
Average molar mass: 255.31 g/mol
Monoisotopic mass: 255.13716217

Names & identifiers

Preferred name: (1Z)-1-hydrazinylidene-4,4,6,9-tetramethyl-4H-pyrrolo[3,2,1-ij]quinolin-2(1H)-one
IUPAC: 3-diazenyl-5,9,11,11-tetramethyl-1-azatricyclo[6.3.1.04,12]dodeca-2,4,6,8(12),9-pentaen-2-ol

Names & synonyms

(1Z)-1-hydrazinylidene-4,4,6,9-tetramethyl-4H-pyrrolo[3,2,1-ij]quinolin-2(1H)-one524047-01-6MLS000778259CHEMBL1465821REGID_for_CID_5425172DTXSID601322548HMS2765L08STK101627AKOS002224908SMR000414934ST501062361-Diazenyl-4,4,6,9-tetramethyl-4H-pyrrolo[3,2,1-ij]quinolin-2-ol

Show more names

1-Hydrazono-4,4,6,9-tetramethyl-1H,4H-pyrrolo[3,2,1-ij]quinolin-2-one(Z)-1-hydrazono-4,4,6,9-tetramethyl-1H-pyrrolo[3,2,1-ij]quinolin-2(4H)-one1-hydrazinylidene-4,4,6,9-tetramethyl-4H-pyrrolo[3,2,1-ij]quinolin-2(1H)-one3-diazenyl-5,9,11,11-tetramethyl-1-azatricyclo[6.3.1.04,12]dodeca-2,4,6,8(12),9-pentaen-2-ol

Database identifiers

CAS: 524047-01-6
PubChem CID: 950744
DTXSID: DTXSID601322548
ChEMBL: CHEMBL1465821

Properties

Computed structural properties

XLogP: 4
Topological polar surface area: 61.4 Å²
Hydrogen bond donors: 2
Hydrogen bond acceptors: 3
Rotatable bonds: 1
Heavy atoms: 19
Formal charge: 0
Complexity: 431

Experimental & physicochemical properties

Solubility1 [ug/mL] (The mean of the results at pH 7.4)

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Compound notes

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