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MU147

CAT: 0931-T205293-02Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0931-T205293-02Size:50 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
2379405-61-3
Target
Endonuclease
Related Pathways
Cell Cycle/Checkpoint
Bioactivity
MU147 is an MRE11 nuclease inhibitor and chemical probe with anticancer properties, exhibiting lethal effects on Ehrlich ascites tumor cells both in vivo and in vitro. It disrupts the MRE11 nuclease-dependent double-strand break repair mechanism without impairing ATM activation. Additionally, MU147 damages the degradation of nascent strands at stalled replication forks and selectively affects BRCA2-deficient cells.
Smiles
N(C(/C(=C/C1=CC(O)=C(O)C=C1)/C#N)=O)C2=NC(=CS2)C3=CC=CC=C3
Molecular Formula
C19H13N3O3S
Molecular Weight
363.39
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

(E)-2-cyano-3-(3,4-dihydroxyphenyl)-N-(4-phenyl-1,3-thiazol-2-yl)prop-2-enamide
CAS Number2379405-61-3
PubChem CID146190004
IUPAC Name(E)-2-cyano-3-(3,4-dihydroxyphenyl)-N-(4-phenyl-1,3-thiazol-2-yl)prop-2-enamide
Molecular FormulaC19H13N3O3S
Molecular Weight363.4
XLogP4
Topological Polar Surface Area134
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count6
Rotatable Bond Count4
Heavy Atom Count26
Formal Charge0
Complexity582
SMILES
C1=CC=C(C=C1)C2=CSC(=N2)NC(=O)/C(=C/C3=CC(=C(C=C3)O)O)/C#N
InChI
InChI=1S/C19H13N3O3S/c20-10-14(8-12-6-7-16(23)17(24)9-12)18(25)22-19-21-15(11-26-19)13-4-2-1-3-5-13/h1-9,11,23-24H,(H,21,22,25)/b14-8+
InChIKey
PQVANVSDCRSXBG-RIYZIHGNSA-N
Chemical Structure
2D Structure
2D structure of (E)-2-cyano-3-(3,4-dihydroxyphenyl)-N-(4-phenyl-1,3-thiazol-2-yl)prop-2-enamide
CAS: 2379405-61-3
CID: 146190004
Formula: C19H13N3O3S
MW: 363.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight363.4
XLogP34
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count6
Rotatable Bond Count4
Exact Mass363.06776246
Monoisotopic Mass363.06776246
Topological Polar Surface Area134 Ų
Heavy Atom Count26
Formal Charge0
Complexity582
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count1
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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