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Uzansertib (INCB053914)

CAT: 0957-S8800-1mgSize: 1 mgDry Ice: NoHazardous: No
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CAT#:0957-S8800-1mgSize:1 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
2088852-47-3
Target
Pim
Applications
JAK/STAT
Smiles
CC1CN (CC (C1O) N) C2=C3CCC (C3=NC=C2NC (=O) C4=NC (=C (C=C4) F) C5=C (C=CC=C5F) F) O.OP (=O) (O) O
Molecular Formula
C26H26F3N5O3.H3O4P
Additionnal Information
Uzansertib (INCB053914) is a novel, ATP-competitive, small molecule, pan-inhibitor of PIM kinases with IC50 values of 0.24 nM, 30 nM and 0.12 nM for PIM1, PIM2 and PIM3 respectively in biochemical assays.
Storage Conditions
3 years -20°C powder

Chemical Information

Uzansertib

Uzansertib is under investigation in clinical trial NCT02587598 (Study of INCB053914 in Subjects With Advanced Malignancies).

CAS Number2088852-47-3
PubChem CID90279868
IUPAC NameN-[(7R)-4-[(3R,4R,5S)-3-amino-4-hydroxy-5-methylpiperidin-1-yl]-7-hydroxy-6,7-dihydro-5H-cyclopenta[b]pyridin-3-yl]-6-(2,6-difluorophenyl)-5-fluoropyridine-2-carboxamide
Molecular FormulaC26H26F3N5O3
Molecular Weight513.5
XLogP1.7
Topological Polar Surface Area125
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count10
Rotatable Bond Count4
Heavy Atom Count37
Formal Charge0
Complexity803
SMILES
C[C@H]1CN(C[C@H]([C@@H]1O)N)C2=C3CC[C@H](C3=NC=C2NC(=O)C4=NC(=C(C=C4)F)C5=C(C=CC=C5F)F)O
InChI
InChI=1S/C26H26F3N5O3/c1-12-10-34(11-17(30)25(12)36)24-13-5-8-20(35)22(13)31-9-19(24)33-26(37)18-7-6-16(29)23(32-18)21-14(27)3-2-4-15(21)28/h2-4,6-7,9,12,17,20,25,35-36H,5,8,10-11,30H2,1H3,(H,33,37)/t12-,17+,20+,25+/m0/s1
InChIKey
PTORCEYGCGXHDH-OVMXCRKPSA-N
Chemical Structure
2D Structure
2D structure of Uzansertib
CAS: 2088852-47-3
CID: 90279868
Formula: C26H26F3N5O3
MW: 513.5
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight513.5
XLogP31.7
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count10
Rotatable Bond Count4
Exact Mass513.19877419
Monoisotopic Mass513.19877419
Topological Polar Surface Area125 Ų
Heavy Atom Count37
Formal Charge0
Complexity803
Isotope Atom Count0
Defined Atom Stereocenter Count4
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes