Products for Research Use Only

BRD 4354

CAT: 0013-GTR19178113-03Size: 5 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19178113-03Size:5 mg
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Description
BRD 4354 is a small molecule inhibitor of HDAC5 (IC50 = 0.85 μM) and HDAC9 (IC50 = 1.88 μM) . It serves as a research tool for investigating the roles of these class IIa HDACs in cardiac remodeling, neurological function, and muscle differentiation in in vitro studies.
CAS Number
315698-07-8
Product Name Alternative
Inhibit, Histone deacetylases, Inhibitor, HDAC, HDAC9, HDAC5, BRD 4354, BRD4354, BRD-4354
Field of Research
Epigenetics & Chromatin, Molecular Biology
Purity
99.08% (May vary between batches)
Solubility
10% DMSO+40% PEG300+5% Tween 80+45% Saline:1 mg/mL (2.61 mM) ; DMSO:10 mg/mL (26.12 mM)
Smiles
CCN1CCN (CC1) C (c1cccnc1) c1cc (Cl) c2cccnc2c1O
Molecular Formula
C21H23ClN4O
Molecular Weight
382.89
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

5-Chloro-7-((4-ethylpiperazin-1-yl)(pyridin-3-yl)methyl)quinolin-8-ol

5-chloro-7-[(4-ethyl-1-piperazinyl)-(3-pyridinyl)methyl]-8-quinolinol is a member of quinolines and an organochlorine compound.

CAS Number315698-07-8
PubChem CID3516032
IUPAC Name5-chloro-7-[(4-ethylpiperazin-1-yl)-pyridin-3-ylmethyl]quinolin-8-ol
Molecular FormulaC21H23ClN4O
Molecular Weight382.9
XLogP3.1
Topological Polar Surface Area52.5
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count4
Heavy Atom Count27
Formal Charge0
Complexity473
SMILES
CCN1CCN(CC1)C(C2=CN=CC=C2)C3=CC(=C4C=CC=NC4=C3O)Cl
InChI
InChI=1S/C21H23ClN4O/c1-2-25-9-11-26(12-10-25)20(15-5-3-7-23-14-15)17-13-18(22)16-6-4-8-24-19(16)21(17)27/h3-8,13-14,20,27H,2,9-12H2,1H3
InChIKey
XAFSFXYJOJWLJD-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 5-Chloro-7-((4-ethylpiperazin-1-yl)(pyridin-3-yl)methyl)quinolin-8-ol
CAS: 315698-07-8
CID: 3516032
Formula: C21H23ClN4O
MW: 382.9
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight382.9
XLogP33.1
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count4
Exact Mass382.1560391
Monoisotopic Mass382.1560391
Topological Polar Surface Area52.5 Ų
Heavy Atom Count27
Formal Charge0
Complexity473
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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