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ON1231320

CAT: 0013-GTR19173251-01Size: 1 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19173251-01Size:1 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
ON1231320
CAS Number
1312471-39-8
Product Name Alternative
Breast, Apoptosis, inhibit, negative, mitosis, ON 1231320, ON1231320, ON-1231320, G2/M, fibroblasts, Inhibitor, GBO-006, GBO006, GBO 006, MDAMB-231, Polo-like Kinase (PLK), PLK2, PLK, phase, triple, U2OS
Field of Research
Cell Biology
Purity
97.31% (May vary between batches)
Solubility
DMSO:4.68 mg/mL (10.01 mM)
Smiles
Cn1c2nc (Nc3ccc4[nH]ccc4c3) ncc2cc (c1=O) S (=O) (=O) c1ccc (F) cc1F
Molecular Formula
C22H15F2N5O3S
Molecular Weight
467.45
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

2-((1H-indol-5-yl)amino)-6-((2,4-difluorophenyl)sulfonyl)-8-methylpyrido[2,3-d]pyrimidin-7(8H)-one
CAS Number1312471-39-8
PubChem CID67240318
IUPAC Name6-(2,4-difluorophenyl)sulfonyl-2-(1H-indol-5-ylamino)-8-methylpyrido[2,3-d]pyrimidin-7-one
Molecular FormulaC22H15F2N5O3S
Molecular Weight467.4
XLogP3.3
Topological Polar Surface Area116
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count8
Rotatable Bond Count4
Heavy Atom Count33
Formal Charge0
Complexity897
SMILES
CN1C2=NC(=NC=C2C=C(C1=O)S(=O)(=O)C3=C(C=C(C=C3)F)F)NC4=CC5=C(C=C4)NC=C5
InChI
InChI=1S/C22H15F2N5O3S/c1-29-20-13(9-19(21(29)30)33(31,32)18-5-2-14(23)10-16(18)24)11-26-22(28-20)27-15-3-4-17-12(8-15)6-7-25-17/h2-11,25H,1H3,(H,26,27,28)
InChIKey
ZEHBZHZMQSHZFI-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2-((1H-indol-5-yl)amino)-6-((2,4-difluorophenyl)sulfonyl)-8-methylpyrido[2,3-d]pyrimidin-7(8H)-one
CAS: 1312471-39-8
CID: 67240318
Formula: C22H15F2N5O3S
MW: 467.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight467.4
XLogP33.3
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count8
Rotatable Bond Count4
Exact Mass467.08636686
Monoisotopic Mass467.08636686
Topological Polar Surface Area116 Ų
Heavy Atom Count33
Formal Charge0
Complexity897
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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