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MBM-17S

CAT: 0013-GTR19205456-02Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19205456-02Size:50 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
MBM-17S is a highly potent and selective Nek2 inhibitor (IC50 = 3 nM) that suppresses cancer cell growth by causing cell cycle arrest and apoptosis. It has demonstrated antitumor efficacy in vivo with no significant toxicity observed in mouse models, making it a valuable tool for oncology and cell cycle research.
CAS Number
2083621-91-2
Field of Research
Cell Biology, Epigenetics & Chromatin, Signal Transduction
Smiles
O=C (CCC (O) =O) O.O=C (C1=C (OCC2=CC=CC=C2) C=C (C3=CN=C4C=C (C5=CN (CCN (C) C) N=C5) C=CN43) C=C1) N.O=C (CCC (O) =O) O
Molecular Formula
C36H40N6O10
Molecular Weight
716.74
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

2-(Benzyloxy)-4-(7-(1-(2-(dimethylamino)ethyl)-1H-pyrazol-4-yl)imidazo[1,2-a]pyridin-3-yl)benzamide disuccinate
CAS Number2083621-91-2
PubChem CID137645850
IUPAC Namebis(butanedioic acid);4-[7-[1-[2-(dimethylamino)ethyl]pyrazol-4-yl]imidazo[1,2-a]pyridin-3-yl]-2-phenylmethoxybenzamide
Molecular FormulaC36H40N6O10
Molecular Weight716.7
Topological Polar Surface Area240
Hydrogen Bond Donor Count5
Hydrogen Bond Acceptor Count13
Rotatable Bond Count15
Heavy Atom Count52
Formal Charge0
Complexity809
SMILES
CN(C)CCN1C=C(C=N1)C2=CC3=NC=C(N3C=C2)C4=CC(=C(C=C4)C(=O)N)OCC5=CC=CC=C5.C(CC(=O)O)C(=O)O.C(CC(=O)O)C(=O)O
InChI
InChI=1S/C28H28N6O2.2C4H6O4/c1-32(2)12-13-33-18-23(16-31-33)21-10-11-34-25(17-30-27(34)15-21)22-8-9-24(28(29)35)26(14-22)36-19-20-6-4-3-5-7-20;2*5-3(6)1-2-4(7)8/h3-11,14-18H,12-13,19H2,1-2H3,(H2,29,35);2*1-2H2,(H,5,6)(H,7,8)
InChIKey
PCGUADBRTABDRN-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2-(Benzyloxy)-4-(7-(1-(2-(dimethylamino)ethyl)-1H-pyrazol-4-yl)imidazo[1,2-a]pyridin-3-yl)benzamide disuccinate
CAS: 2083621-91-2
CID: 137645850
Formula: C36H40N6O10
MW: 716.7
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight716.7
Hydrogen Bond Donor Count5
Hydrogen Bond Acceptor Count13
Rotatable Bond Count15
Exact Mass716.28059149
Monoisotopic Mass716.28059149
Topological Polar Surface Area240 Ų
Heavy Atom Count52
Formal Charge0
Complexity809
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count3
Compound Is CanonicalizedYes

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