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MNK1/2-IN-5

CAT: 0931-T60733-01Size: 1 mgDry Ice: NoHazardous: No
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CAT#:0931-T60733-01Size:1 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
1426928-20-2
Target
MNK
Related Pathways
MAPK
Purity
0.9804
Bioactivity
MNK1/2-IN-5 is a potent and selective MNK1/2 inhibitor with anticancer activity and can be used to study solid tumors and hematological malignancies.
Smiles
O([C@@H](CN)C)C1=NN2C(=CN=C2C=C1)C3=CC=4C(O3)=CC=CC4
Molecular Formula
C17H16N4O2
Molecular Weight
308.33
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

Mnk1/2-IN-5
CAS Number1426928-20-2
PubChem CID71468412
IUPAC Name(2R)-2-[3-(1-benzofuran-2-yl)imidazo[1,2-b]pyridazin-6-yl]oxypropan-1-amine
Molecular FormulaC17H16N4O2
Molecular Weight308.33
XLogP2.2
Topological Polar Surface Area78.6
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count4
Heavy Atom Count23
Formal Charge0
Complexity410
SMILES
C[C@H](CN)OC1=NN2C(=NC=C2C3=CC4=CC=CC=C4O3)C=C1
InChI
InChI=1S/C17H16N4O2/c1-11(9-18)22-17-7-6-16-19-10-13(21(16)20-17)15-8-12-4-2-3-5-14(12)23-15/h2-8,10-11H,9,18H2,1H3/t11-/m1/s1
InChIKey
CMDIADSAZCFCCT-LLVKDONJSA-N
Chemical Structure
2D Structure
2D structure of Mnk1/2-IN-5
CAS: 1426928-20-2
CID: 71468412
Formula: C17H16N4O2
MW: 308.33
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight308.33
XLogP32.2
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count4
Exact Mass308.12732577
Monoisotopic Mass308.12732577
Topological Polar Surface Area78.6 Ų
Heavy Atom Count23
Formal Charge0
Complexity410
Isotope Atom Count0
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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