Catalog No.:AA000E35

117337-19-6 | Acetic acid, 2-[[2-chloro-4-fluoro-5-[(tetrahydro-3-oxo-1H,3H-[1,3,4]thiadiazolo[3,4-a]pyridazin-1-ylidene)amino]phenyl]thio]-, methyl ester

Name: Name:Acetic acid, 2-[[2-chloro-4-fluoro-5-[(tetrahydro-3-oxo-1H,3H-[1,3,4]thiadiazolo[3,4-a]pyridazin-1-ylidene)amino]phenyl]thio]-, methyl ester
Brand: AABLOCKS
SKU: AA000E35
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25mg

≥98% (GC)

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100mg

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Technical Information
Properties
Literature
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Technical Information
Properties
Literature

Technical Information

Catalog Number:

AA000E35

Chemical Name:

Acetic acid, 2-[[2-chloro-4-fluoro-5-[(tetrahydro-3-oxo-1H,3H-[1,3,4]thiadiazolo[3,4-a]pyridazin-1-ylidene)amino]phenyl]thio]-, methyl ester

CAS Number:

117337-19-6

Molecular Formula:

C15H15ClFN3O3S2

Molecular Weight:

403.8793

MDL Number:

MFCD03792701

SMILES:

COC(=O)CSc1cc(N=c2sc(=O)n3n2CCCC3)c(cc1Cl)F

Properties

Computed Properties

Complexity:

568

Covalently-Bonded Unit Count:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Rotatable Bond Count:

XLogP3:

3.9

Literature

Title: 8-Thia-1,6-diaza-bicyclo-[4.3.0]nonane-7,9-dione.

Journal: Acta crystallographica. Section E, Structure reports online 20111001

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