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MUN36378

CAT: 0931-T9852-07Size: 100 mgDry Ice: NoHazardous: No
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CAT#:0931-T9852-07Size:100 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
2243736-37-8
Target
Others
Related Pathways
Others
Purity
0.997
Bioactivity
MUN36378 is a FTO inhibitor for treatment of leukemia.
Smiles
CC=1C(=C(C)NN1)C2=CC(Cl)=C(NC3=C(C(O)=O)C=CC=C3)C(Cl)=C2
Molecular Formula
C18H15Cl2N3O2
Molecular Weight
376.24
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

Fto-IN-7
CAS Number2243736-37-8
PubChem CID148456336
IUPAC Name2-[2,6-dichloro-4-(3,5-dimethyl-1H-pyrazol-4-yl)anilino]benzoic acid
Molecular FormulaC18H15Cl2N3O2
Molecular Weight376.2
XLogP5.5
Topological Polar Surface Area78
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count4
Rotatable Bond Count4
Heavy Atom Count25
Formal Charge0
Complexity469
SMILES
CC1=C(C(=NN1)C)C2=CC(=C(C(=C2)Cl)NC3=CC=CC=C3C(=O)O)Cl
InChI
InChI=1S/C18H15Cl2N3O2/c1-9-16(10(2)23-22-9)11-7-13(19)17(14(20)8-11)21-15-6-4-3-5-12(15)18(24)25/h3-8,21H,1-2H3,(H,22,23)(H,24,25)
InChIKey
MCENODSHXUWMEL-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Fto-IN-7
CAS: 2243736-37-8
CID: 148456336
Formula: C18H15Cl2N3O2
MW: 376.2
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight376.2
XLogP35.5
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count4
Rotatable Bond Count4
Exact Mass375.0541321
Monoisotopic Mass375.0541321
Topological Polar Surface Area78 Ų
Heavy Atom Count25
Formal Charge0
Complexity469
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

Alternative Products

CatalogName
MBS133613MUN36378

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