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MTDH-SND1 blocker 1

CAT: 0931-T84918-01Size: 10 mgDry Ice: NoHazardous: No
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CAT#:0931-T84918-01Size:10 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
1341030-00-9
Target
Others, Histone Methyltransferase
Related Pathways
Others, Chromatin/Epigenetic
Bioactivity
MTDH-SND1 Blocker 1 (Compound C26-A6) serves as an inhibitor targeting the MTDH-SND1 protein, effectively suppressing cancer metastasis [1].
Smiles
N(S(=O)(=O)C1=C(OC)C=CC(Cl)=C1)C=2C=3N(N=C(C)N3)C=CC2
Molecular Formula
C14H13ClN4O3S
Molecular Weight
352.8
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

MTDH-SND1 blocker 1
CAS Number1341030-00-9
PubChem CID87054166
IUPAC Name5-chloro-2-methoxy-N-(2-methyl-[1,2,4]triazolo[1,5-a]pyridin-8-yl)benzenesulfonamide
Molecular FormulaC14H13ClN4O3S
Molecular Weight352.8
XLogP2.3
Topological Polar Surface Area94
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count6
Rotatable Bond Count4
Heavy Atom Count23
Formal Charge0
Complexity515
SMILES
CC1=NN2C=CC=C(C2=N1)NS(=O)(=O)C3=C(C=CC(=C3)Cl)OC
InChI
InChI=1S/C14H13ClN4O3S/c1-9-16-14-11(4-3-7-19(14)17-9)18-23(20,21)13-8-10(15)5-6-12(13)22-2/h3-8,18H,1-2H3
InChIKey
HLRMNXITZQAUIH-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of MTDH-SND1 blocker 1
CAS: 1341030-00-9
CID: 87054166
Formula: C14H13ClN4O3S
MW: 352.8
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight352.8
XLogP32.3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count6
Rotatable Bond Count4
Exact Mass352.0396892
Monoisotopic Mass352.0396892
Topological Polar Surface Area94 Ų
Heavy Atom Count23
Formal Charge0
Complexity515
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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