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TRX-0237

CAT: 1410-M15309Size: 1 EachDry Ice: NoHazardous: No
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Description
TRX-0237 Methylate (Hydromethylthionine, Methylene blue) is a Tau aggregation inhibitor (TAI) with Ki of 0.12 uM for intracellular TAI activity.
CAS Number
613-11-6
Stability
≥ 2 years
Purity
>98% (HPLC)
Weight
379.493
Molecular Formula
C16H19N3S
Notes
Research use only, not for human use.
Receptor
Amyloids

Chemical Information

Leucomethylene blue

Leucomethylene blue is a member of the class of phenothiazines that is 10H-phenothiazine in which the ring hydrogens at positions 3 and 7 have been replaced by dimethylamino groups. It has a role as a fluorochrome, a mouse metabolite, a bacterial xenobiotic metabolite and a rat metabolite. It is an aromatic amine, a member of phenothiazines and a tertiary amino compound.

CAS Number613-11-6
PubChem CID164695
IUPAC Name3-N,3-N,7-N,7-N-tetramethyl-10H-phenothiazine-3,7-diamine
Molecular FormulaC16H19N3S
Molecular Weight285.4
XLogP3.9
Topological Polar Surface Area43.8
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count2
Heavy Atom Count20
Formal Charge0
Complexity304
SMILES
CN(C)C1=CC2=C(C=C1)NC3=C(S2)C=C(C=C3)N(C)C
InChI
InChI=1S/C16H19N3S/c1-18(2)11-5-7-13-15(9-11)20-16-10-12(19(3)4)6-8-14(16)17-13/h5-10,17H,1-4H3
InChIKey
QTWZICCBKBYHDM-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Leucomethylene blue
CAS: 613-11-6
CID: 164695
Formula: C16H19N3S
MW: 285.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight285.4
XLogP33.9
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count2
Exact Mass285.12996879
Monoisotopic Mass285.12996879
Topological Polar Surface Area43.8 Ų
Heavy Atom Count20
Formal Charge0
Complexity304
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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