Products for Research Use Only

SR-2890

CAT: 0013-GTR19258826-02Size: 5 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19258826-02Size:5 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
SR-2890 is a potent and highly selective casein kinase 1δ/1ε (CK1δ/ε) inhibitor with an IC50 of 4 nM for CK1δ. This compound inhibits melanoma A375 cell growth with an EC50 of 38 nM in MTT assays and possesses pharmacokinetic properties suitable for xenograft studies using human cancer cell lines.
CAS Number
1454584-91-8
Product Name Alternative
SR2890
Field of Research
Metabolism Research, Stem Cell & Developmental Biology
Purity
99.10% (May vary between batches)
Smiles
FC1=CC=CC (=C1) N2C=NC=3C (=NC (=NC32) N4CCNCC4) NCC5=NC=6C=CC (Cl) =CC6N5
Molecular Formula
C23H21ClFN9
Molecular Weight
477.93
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

N-[(6-chloro-1H-benzimidazol-2-yl)methyl]-9-(3-fluorophenyl)-2-piperazin-1-ylpurin-6-amine
CAS Number1454584-91-8
PubChem CID56947189
IUPAC NameN-[(6-chloro-1H-benzimidazol-2-yl)methyl]-9-(3-fluorophenyl)-2-piperazin-1-ylpurin-6-amine
Molecular FormulaC23H21ClFN9
Molecular Weight477.9
XLogP3.7
Topological Polar Surface Area99.6
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count8
Rotatable Bond Count5
Heavy Atom Count34
Formal Charge0
Complexity685
SMILES
C1CN(CCN1)C2=NC(=C3C(=N2)N(C=N3)C4=CC(=CC=C4)F)NCC5=NC6=C(N5)C=C(C=C6)Cl
InChI
InChI=1S/C23H21ClFN9/c24-14-4-5-17-18(10-14)30-19(29-17)12-27-21-20-22(32-23(31-21)33-8-6-26-7-9-33)34(13-28-20)16-3-1-2-15(25)11-16/h1-5,10-11,13,26H,6-9,12H2,(H,29,30)(H,27,31,32)
InChIKey
NGIQKILKGCPSJO-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of N-[(6-chloro-1H-benzimidazol-2-yl)methyl]-9-(3-fluorophenyl)-2-piperazin-1-ylpurin-6-amine
CAS: 1454584-91-8
CID: 56947189
Formula: C23H21ClFN9
MW: 477.9
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight477.9
XLogP33.7
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count8
Rotatable Bond Count5
Exact Mass477.1592476
Monoisotopic Mass477.1592476
Topological Polar Surface Area99.6 Ų
Heavy Atom Count34
Formal Charge0
Complexity685
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