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CCT020312

CAT: 1568-C01437-02Size: 10 mM / 1 mLDry Ice: NoHazardous: No
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CAT#:1568-C01437-02Size:10 mM / 1 mL
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
324759-76-4
SKU
C01437-5mg
Target
PERK
Applications
Apoptosis
Smiles
CCN (CC) CCC (=O) N1N=C (CC1C2=CC=C (Br) C=C2) C3=C (C4=CC=CC=C4) C5=C (NC3=O) C=CC (=C5) Br
Additionnal Information
CCT020312 is a selective PERK (EIF2AK3) activator with an EC50 of 5.1 μM. CCT020312 can be used for the selective activation of EIF2A-mediated translation control.
Storage Conditions
3 years -20°C powder

Chemical Information

6-Bromo-3-[3-(4-bromophenyl)-2-[3-(diethylamino)propanoyl]-3,4-dihydropyrazol-5-yl]-4-phenyl-1H-quinolin-2-one
CAS Number324759-76-4
PubChem CID3108148
IUPAC Name6-bromo-3-[3-(4-bromophenyl)-2-[3-(diethylamino)propanoyl]-3,4-dihydropyrazol-5-yl]-4-phenyl-1H-quinolin-2-one
Molecular FormulaC31H30Br2N4O2
Molecular Weight650.4
XLogP5.6
Topological Polar Surface Area65
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count8
Heavy Atom Count39
Formal Charge0
Complexity950
SMILES
CCN(CC)CCC(=O)N1C(CC(=N1)C2=C(C3=C(C=CC(=C3)Br)NC2=O)C4=CC=CC=C4)C5=CC=C(C=C5)Br
InChI
InChI=1S/C31H30Br2N4O2/c1-3-36(4-2)17-16-28(38)37-27(20-10-12-22(32)13-11-20)19-26(35-37)30-29(21-8-6-5-7-9-21)24-18-23(33)14-15-25(24)34-31(30)39/h5-15,18,27H,3-4,16-17,19H2,1-2H3,(H,34,39)
InChIKey
OAXDKXMGESZLKV-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 6-Bromo-3-[3-(4-bromophenyl)-2-[3-(diethylamino)propanoyl]-3,4-dihydropyrazol-5-yl]-4-phenyl-1H-quinolin-2-one
CAS: 324759-76-4
CID: 3108148
Formula: C31H30Br2N4O2
MW: 650.4
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight650.4
XLogP35.6
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count8
Exact Mass650.07150
Monoisotopic Mass648.07355
Topological Polar Surface Area65 Ų
Heavy Atom Count39
Formal Charge0
Complexity950
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