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GSK-1268997

CAT: 0931-T32003-01Size: 1 mgDry Ice: NoHazardous: No
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CAT#:0931-T32003-01Size:1 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
1414375-50-0
Target
Histone Methyltransferase
Related Pathways
Chromatin/Epigenetic
Purity
0.9981
Bioactivity
GSK-1268997 is a PRMT5 inhibitor and can be used to study advanced solid tumors.
Smiles
O=S(=O)(N)C1=CC(=CC=C1CO)NC2=NC=CC(=N2)N(C=3C=CC=4C(=NN(C4C)C)C3)C
Molecular Formula
C21H23N7O3S
Molecular Weight
453.52
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

Pazopanib metabolite M26
CAS Number1414375-50-0
PubChem CID72942038
IUPAC Name5-[[4-[(2,3-dimethylindazol-6-yl)-methylamino]pyrimidin-2-yl]amino]-2-(hydroxymethyl)benzenesulfonamide
Molecular FormulaC21H23N7O3S
Molecular Weight453.5
XLogP1.8
Topological Polar Surface Area148
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count9
Rotatable Bond Count6
Heavy Atom Count32
Formal Charge0
Complexity735
SMILES
CC1=C2C=CC(=CC2=NN1C)N(C)C3=NC(=NC=C3)NC4=CC(=C(C=C4)CO)S(=O)(=O)N
InChI
InChI=1S/C21H23N7O3S/c1-13-17-7-6-16(11-18(17)26-28(13)3)27(2)20-8-9-23-21(25-20)24-15-5-4-14(12-29)19(10-15)32(22,30)31/h4-11,29H,12H2,1-3H3,(H2,22,30,31)(H,23,24,25)
InChIKey
FHOXOPMJIMHUOC-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Pazopanib metabolite M26
CAS: 1414375-50-0
CID: 72942038
Formula: C21H23N7O3S
MW: 453.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight453.5
XLogP31.8
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count9
Rotatable Bond Count6
Exact Mass453.15830879
Monoisotopic Mass453.15830879
Topological Polar Surface Area148 Ų
Heavy Atom Count32
Formal Charge0
Complexity735
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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