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M1002

CAT: 1410-M35596-01Size: 5 mgDry Ice: NoHazardous: No
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CAT#:1410-M35596-01Size:5 mg
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Description
M1002 is a hypoxia-inducible factor-2 (HIF-2) agonist that enhances the affinity of HIF-2alpha and ARNT for transcriptional activation. It alters the Tyr2 conformation of the HIF-2alpha PAS-B structural domain and acts synergistically with inhibitors of the prolyl hydroxylase structural domain (PHD) .
CAS Number
823830-85-9
Stability
≥ 2 years
Purity
>98% (HPLC)
Weight
394.29
Molecular Formula
C15H8F6N2O2S
Notes
Research use only, not for human use.
Receptor
HIF

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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