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Merck60

CAT: 1410-M16166-02Size: 1 mL x 10 mM in DMSODry Ice: NoHazardous: No
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CAT#:1410-M16166-02Size:1 mL x 10 mM in DMSO
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
Merck60 (BRD 6929, Compound-60) is a potent, selective and brain-penetrant inhibitor of HDAC1 and HDAC2 with IC50 of 1 nM and 8 nM respectively.
CAS Number
849234-64-6
Stability
≥ 2 years
Purity
>98% (HPLC)
Weight
351.424
Molecular Formula
C19H17N3O2S
Notes
Research use only, not for human use.
Receptor
HDAC

Chemical Information

HDAC inhibitor, Compound 1

4-acetamido-N-(2-amino-5-thiophen-2-ylphenyl)benzamide is a member of benzamides.

CAS Number849234-64-6
PubChem CID6918878
IUPAC Name4-acetamido-N-(2-amino-5-thiophen-2-ylphenyl)benzamide
Molecular FormulaC19H17N3O2S
Molecular Weight351.4
XLogP2.6
Topological Polar Surface Area112
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count4
Rotatable Bond Count4
Heavy Atom Count25
Formal Charge0
Complexity479
SMILES
CC(=O)NC1=CC=C(C=C1)C(=O)NC2=C(C=CC(=C2)C3=CC=CS3)N
InChI
InChI=1S/C19H17N3O2S/c1-12(23)21-15-7-4-13(5-8-15)19(24)22-17-11-14(6-9-16(17)20)18-3-2-10-25-18/h2-11H,20H2,1H3,(H,21,23)(H,22,24)
InChIKey
ABZSPJVXTTUFAA-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of HDAC inhibitor, Compound 1
CAS: 849234-64-6
CID: 6918878
Formula: C19H17N3O2S
MW: 351.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight351.4
XLogP32.6
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count4
Rotatable Bond Count4
Exact Mass351.10414797
Monoisotopic Mass351.10414797
Topological Polar Surface Area112 Ų
Heavy Atom Count25
Formal Charge0
Complexity479
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
MBS3606164-01Merck60

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