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PIM447

CAT: 0931-T12475-05Size: 25 mgDry Ice: NoHazardous: No
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CAT#:0931-T12475-05Size:25 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
1210608-43-7
Target
Pim, Apoptosis
Related Pathways
Apoptosis, Chromatin/Epigenetic, JAK/STAT signaling
Purity
0.9897
Bioactivity
PIM447 (LGH447) is an oral, selective pan-PIM kinase inhibitor with antitumor and bone-protective effects. It inhibits PIM1, PIM2, and PIM3, induces apoptosis, and decreases the viability, proliferation, and motility of HuH6 and COA67 cells. PIM447 suppresses tumorigenesis in hepatocellular carcinoma and can be used in the study of multiple myeloma.
Smiles
FC1=C(N=C(C(NC=2C(=CC=NC2)[C@@H]3C[C@H](C)C[C@H](N)C3)=O)C=C1)C4=C(F)C=CC=C4F
Molecular Formula
C24H23F3N4O
Molecular Weight
440.46
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

Lgh-447

LGH-447 is under investigation in clinical trial NCT02160951 (Dose Escalation Study of LGH447 in Japanese Patients With Relapsed and/or Refractory Hematologic Malignancies).

CAS Number1210608-43-7
PubChem CID44814409
IUPAC NameN-[4-[(1R,3S,5S)-3-amino-5-methylcyclohexyl]-3-pyridinyl]-6-(2,6-difluorophenyl)-5-fluoropyridine-2-carboxamide
Molecular FormulaC24H23F3N4O
Molecular Weight440.5
XLogP3.9
Topological Polar Surface Area80.9
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count7
Rotatable Bond Count4
Heavy Atom Count32
Formal Charge0
Complexity630
SMILES
C[C@H]1C[C@H](C[C@H](C1)N)C2=C(C=NC=C2)NC(=O)C3=NC(=C(C=C3)F)C4=C(C=CC=C4F)F
InChI
InChI=1S/C24H23F3N4O/c1-13-9-14(11-15(28)10-13)16-7-8-29-12-21(16)31-24(32)20-6-5-19(27)23(30-20)22-17(25)3-2-4-18(22)26/h2-8,12-15H,9-11,28H2,1H3,(H,31,32)/t13-,14+,15-/m0/s1
InChIKey
VRQXRVAKPDCRCI-ZNMIVQPWSA-N
Chemical Structure
2D Structure
2D structure of Lgh-447
CAS: 1210608-43-7
CID: 44814409
Formula: C24H23F3N4O
MW: 440.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight440.5
XLogP33.9
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count7
Rotatable Bond Count4
Exact Mass440.18239586
Monoisotopic Mass440.18239586
Topological Polar Surface Area80.9 Ų
Heavy Atom Count32
Formal Charge0
Complexity630
Isotope Atom Count0
Defined Atom Stereocenter Count3
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Alternative Products

CatalogName
C04803PIM447
MBS3841787-01PIM447 (LGH447)
AR-P31625-01PIM447 2HCl
A16807-10PIM447 (LGH447) 10mg
C13103-10mM/1mLPIM447 (LGH447) Hydrochloride
A16807-50PIM447 (LGH447) 50mg
A16807-25PIM447 (LGH447) 25mg
A16807-2PIM447 (LGH447) 2mg
A16807-1PIM447 (LGH447) 1mg
A16807-5PIM447 (LGH447) 5mg

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