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M1002

CAT: 0804-HY-139287-05Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0804-HY-139287-05Size:50 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
M1002 is a hypoxia-inducible factor-2 (HIF-2) agonist, and can enhance the expression of HIF-2 target genes. M1002 shows synergy with prolyl-hydroxylase domain (PHD) inhibitors[1].
CAS Number
823830-85-9
UNSPSC
12352005
Target
HIF/HIF Prolyl-Hydroxylase
Type
Reference compound
Related Pathways
Metabolic Enzyme/Protease
Applications
Cancer-programmed cell death
Field of Research
Cancer
Assay Protocol
https://www.medchemexpress.com/m1002.html
Concentration
10mM
Purity
99.69
Solubility
DMF : 50 mg/mL (ultrasonic) |DMSO : 50 mg/mL (ultrasonic; warming; heat to 60°C)
Smiles
O=S1(N=C(C2=C1C=CC=C2)NC3=CC(C(F)(F)F)=CC(C(F)(F)F)=C3)=O
Molecular Formula
C15H8F6N2O2S
Molecular Weight
394.30
References & Citations
[1]Dalei Wu, et al. Bidirectional modulation of HIF-2 activity through chemical ligands. Nat Chem Biol. 2019 Apr;15 (4) :367-376.
Shipping Conditions
Blue Ice
Storage Conditions
-20°C, 3 years (Powder)
Scientific Category
Reference compound1
Clinical Information
No Development Reported

Chemical Information

N-[3,5-bis(trifluoromethyl)phenyl]-1,2-benzothiazol-3-amine 1,1-dioxide
CAS Number823830-85-9
PubChem CID2220129
IUPAC NameN-[3,5-bis(trifluoromethyl)phenyl]-1,1-dioxo-1,2-benzothiazol-3-amine
Molecular FormulaC15H8F6N2O2S
Molecular Weight394.29
XLogP3.8
Topological Polar Surface Area66.9
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count9
Rotatable Bond Count2
Heavy Atom Count26
Formal Charge0
Complexity645
SMILES
C1=CC=C2C(=C1)C(=NS2(=O)=O)NC3=CC(=CC(=C3)C(F)(F)F)C(F)(F)F
InChI
InChI=1S/C15H8F6N2O2S/c16-14(17,18)8-5-9(15(19,20)21)7-10(6-8)22-13-11-3-1-2-4-12(11)26(24,25)23-13/h1-7H,(H,22,23)
InChIKey
BMTRZTPPTZHACH-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of N-[3,5-bis(trifluoromethyl)phenyl]-1,2-benzothiazol-3-amine 1,1-dioxide
CAS: 823830-85-9
CID: 2220129
Formula: C15H8F6N2O2S
MW: 394.29
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight394.29
XLogP33.8
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count9
Rotatable Bond Count2
Exact Mass394.02106765
Monoisotopic Mass394.02106765
Topological Polar Surface Area66.9 Ų
Heavy Atom Count26
Formal Charge0
Complexity645
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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