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SDR-04

CAT: 0931-T60996-02Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0931-T60996-02Size:50 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
879593-54-1
Target
Epigenetic Reader Domain, Others
Related Pathways
Others, Chromatin/Epigenetic
Bioactivity
SDR-04 shows strong affinity and inhibition activity of BRD4-BD1. SDR-04 is an inhibitor of BET that effectively suppresses the proliferation of MV4;11 cancer cell line [1].
Smiles
N(C1=C(N=C2N1C=CN=C2)C3=CC(OC)=C(O)C=C3)C4=CC=CC=C4
Molecular Formula
C19H16N4O2
Molecular Weight
332.36
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

2-Methoxy-4-(3-phenylimino-1,7-dihydroimidazo[1,2-a]pyrazin-2-ylidene)-1-cyclohexa-2,5-dienone

2-methoxy-4-(3-phenylimino-1,7-dihydroimidazo[1,2-a]pyrazin-2-ylidene)-1-cyclohexa-2,5-dienone is a member of quinomethanes.

CAS Number879593-54-1
PubChem CID5309317
IUPAC Name4-(3-anilinoimidazo[1,2-a]pyrazin-2-yl)-2-methoxyphenol
Molecular FormulaC19H16N4O2
Molecular Weight332.4
XLogP3.8
Topological Polar Surface Area71.7
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count4
Heavy Atom Count25
Formal Charge0
Complexity432
SMILES
COC1=C(C=CC(=C1)C2=C(N3C=CN=CC3=N2)NC4=CC=CC=C4)O
InChI
InChI=1S/C19H16N4O2/c1-25-16-11-13(7-8-15(16)24)18-19(21-14-5-3-2-4-6-14)23-10-9-20-12-17(23)22-18/h2-12,21,24H,1H3
InChIKey
KZMVPUIBSUVYJZ-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2-Methoxy-4-(3-phenylimino-1,7-dihydroimidazo[1,2-a]pyrazin-2-ylidene)-1-cyclohexa-2,5-dienone
CAS: 879593-54-1
CID: 5309317
Formula: C19H16N4O2
MW: 332.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight332.4
XLogP33.8
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count4
Exact Mass332.12732577
Monoisotopic Mass332.12732577
Topological Polar Surface Area71.7 Ų
Heavy Atom Count25
Formal Charge0
Complexity432
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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