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DW34

CAT: 0931-T210782-01Size: 10 mgDry Ice: NoHazardous: No
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CAT#:0931-T210782-01Size:10 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
2758171-54-7
Target
Necroptosis, Epigenetic Reader Domain
Related Pathways
Apoptosis, Chromatin/Epigenetic
Bioactivity
DW34 is an orally bioactive pan-BRD4-D1-biased inhibitor that also exhibits BRD4-D2 activity. It demonstrates a low nanomolar inhibitory effect comparable to I-BET151 (EC50 value of 0.16 μM), with an EC50 value of 0.14 μM. DW34 significantly alleviates lipopolysaccharide (LPS) -induced liver inflammation and acetaminophen (APAP) -induced toxicity by reducing chemokine expression and cell necrosis.
Smiles
N1=NN(C(C=2N=C(OC=3C=C(C=C(C3)C)C)C=CC2)=C1C)C4CCN(CCN(C)C)CC4
Molecular Formula
C25H34N6O
Molecular Weight
434.58
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

2-(4-{5-[6-(3,5-dimethylphenoxy)pyridin-2-yl]-4-methyl-1H-1,2,3-triazol-1-yl}piperidin-1-yl)-N,N-dimethylethan-1-amine
CAS Number2758171-54-7
PubChem CID156022514
IUPAC Name2-[4-[5-[6-(3,5-dimethylphenoxy)-2-pyridinyl]-4-methyltriazol-1-yl]piperidin-1-yl]-N,N-dimethylethanamine
Molecular FormulaC25H34N6O
Molecular Weight434.6
XLogP3.8
Topological Polar Surface Area59.3
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count6
Rotatable Bond Count7
Heavy Atom Count32
Formal Charge0
Complexity559
SMILES
CC1=CC(=CC(=C1)OC2=CC=CC(=N2)C3=C(N=NN3C4CCN(CC4)CCN(C)C)C)C
InChI
InChI=1S/C25H34N6O/c1-18-15-19(2)17-22(16-18)32-24-8-6-7-23(26-24)25-20(3)27-28-31(25)21-9-11-30(12-10-21)14-13-29(4)5/h6-8,15-17,21H,9-14H2,1-5H3
InChIKey
PIKWYDHWUKSWAQ-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2-(4-{5-[6-(3,5-dimethylphenoxy)pyridin-2-yl]-4-methyl-1H-1,2,3-triazol-1-yl}piperidin-1-yl)-N,N-dimethylethan-1-amine
CAS: 2758171-54-7
CID: 156022514
Formula: C25H34N6O
MW: 434.6
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight434.6
XLogP33.8
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count6
Rotatable Bond Count7
Exact Mass434.27940973
Monoisotopic Mass434.27940973
Topological Polar Surface Area59.3 Ų
Heavy Atom Count32
Formal Charge0
Complexity559
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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