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NU6140

CAT: 0013-GTR19155149-07Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19155149-07Size:50 mg
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Description
NU6140 is a selective inhibitor of CDK2-cyclin A (IC50, 0.41 μM) . It shows 10- to 36-fold selectivity over other CDKs. NU6140 also effectively inhibits Aurora A and Aurora B (IC50s: 67 and 35 nM, respectively) . It also enhances the apoptotic effect and has anti-cancer activity.
CAS Number
444723-13-1
Purity
>98% (HPLC)
Solubility
DMSO:250 mg/mL (591.69 mM; Need ultrasonic)
Smiles
CCN (CC) C (C (C=C1) =CC=C1NC2=NC (OCC3CCCCC3) =C4C (N=CN4) =N2) =O
Molecular Formula
C23H30N6O2
Molecular Weight
422.52
Storage Conditions
Storage temperature: -20°C. Stability: ≥ 2 years
Notes
For research use only.

Chemical Information

NU6140
CAS Number444723-13-1
PubChem CID10202471
IUPAC Name4-[[6-(cyclohexylmethoxy)-7H-purin-2-yl]amino]-N,N-diethylbenzamide
Molecular FormulaC23H30N6O2
Molecular Weight422.5
XLogP4.8
Topological Polar Surface Area96
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count6
Rotatable Bond Count8
Heavy Atom Count31
Formal Charge0
Complexity560
SMILES
CCN(CC)C(=O)C1=CC=C(C=C1)NC2=NC3=C(C(=N2)OCC4CCCCC4)NC=N3
InChI
InChI=1S/C23H30N6O2/c1-3-29(4-2)22(30)17-10-12-18(13-11-17)26-23-27-20-19(24-15-25-20)21(28-23)31-14-16-8-6-5-7-9-16/h10-13,15-16H,3-9,14H2,1-2H3,(H2,24,25,26,27,28)
InChIKey
XHEQSRJCJTWWAH-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of NU6140
CAS: 444723-13-1
CID: 10202471
Formula: C23H30N6O2
MW: 422.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight422.5
XLogP34.8
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count6
Rotatable Bond Count8
Exact Mass422.24302422
Monoisotopic Mass422.24302422
Topological Polar Surface Area96 Ų
Heavy Atom Count31
Formal Charge0
Complexity560
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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