10-(N-Methylpiperidyliden-4)-1-azathioxanthene

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Basic information

CAS: 23256-08-8
Standard SMILES: CN1CCC(=C2c3ccccc3Sc3cccnc32)CC1
InChIKey: VDUZTAFGMNZUJR-UHFFFAOYSA-N
Molecular formula: C18H18N2S
Average molar mass: 294.4 g/mol
Monoisotopic mass: 294.11906976

Names & identifiers

Preferred name: 10-(N-Methylpiperidyliden-4)-1-azathioxanthene
IUPAC: 10-(1-methylpiperidin-4-ylidene)thiochromeno[3,2-b]pyridine

Names & synonyms

HCC6FW5Z4UUNII-HCC6FW5Z4U10-(N-Methylpiperidyliden-4)-1-azathioxanthene47124-87-810-(1-Methyl-4-piperidinylidene)-10H-(1)benzothiopyrano(3,2-b)pyridine10H-(1)Benzothiopyrano(3,2-b)pyridine, 10-(1-methyl-4-piperidinylidene)-SCHEMBL9212993DTXSID4027492510-(1-methylpiperidin-4-ylidene)thiochromeno[3,2-b]pyridine10-(1-Methylpiperidin-4-ylidene)-10H-[1]benzothiopyrano[3,2-b]pyridine

Database identifiers

CAS: 23256-08-8、47124-87-8
PubChem CID: 31768
DTXSID: DTXSID40274925
UNII: HCC6FW5Z4U

Properties

Computed structural properties

XLogP: 2.9
Topological polar surface area: 41.4 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 3
Rotatable bonds: 0
Heavy atoms: 21
Formal charge: 0
Complexity: 409

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Compound notes

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