Products for Research Use Only
RegisterLogin

GSK321

CAT: 1410-M34615-02Size: 2 mgDry Ice: NoHazardous: No
Product image 1
1 / 1
CAT#:1410-M34615-02Size:2 mg
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
Description
GSK321 is a selective and potent mutant isocitrate dehydrogenase 1 (IDH1) inhibitor that inhibits lipid synthesis and blocks cell proliferation in OPA1-deficient MEFs and prevents cytoplasmic glutamine reductive carboxylation.GSK321 has been used in the study of leukemia.
CAS Number
1816331-63-1
Stability
≥ 2 years
Purity
>98% (HPLC)
Weight
501.55
Molecular Formula
C28H28FN5O3
Notes
Research use only, not for human use.
Receptor
Dehydrogenase

Chemical Information

(R)-1-(4-fluorobenzyl)-N-(3-((S)-1-hydroxyethyl)phenyl)-7-methyl-5-(1H-pyrrole-2-carbonyl)-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridine-3-carboxamide
CAS Number1816331-63-1
PubChem CID91864709
IUPAC Name(7R)-1-[(4-fluorophenyl)methyl]-N-[3-[(1S)-1-hydroxyethyl]phenyl]-7-methyl-5-(1H-pyrrole-2-carbonyl)-6,7-dihydro-4H-pyrazolo[4,5-c]pyridine-3-carboxamide
Molecular FormulaC28H28FN5O3
Molecular Weight501.6
XLogP3.1
Topological Polar Surface Area103
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count5
Rotatable Bond Count6
Heavy Atom Count37
Formal Charge0
Complexity809
SMILES
C[C@@H]1CN(CC2=C1N(N=C2C(=O)NC3=CC=CC(=C3)[C@H](C)O)CC4=CC=C(C=C4)F)C(=O)C5=CC=CN5
InChI
InChI=1S/C28H28FN5O3/c1-17-14-33(28(37)24-7-4-12-30-24)16-23-25(27(36)31-22-6-3-5-20(13-22)18(2)35)32-34(26(17)23)15-19-8-10-21(29)11-9-19/h3-13,17-18,30,35H,14-16H2,1-2H3,(H,31,36)/t17-,18+/m1/s1
InChIKey
IVFDDVKCCBDPQZ-MSOLQXFVSA-N
Chemical Structure
2D Structure
2D structure of (R)-1-(4-fluorobenzyl)-N-(3-((S)-1-hydroxyethyl)phenyl)-7-methyl-5-(1H-pyrrole-2-carbonyl)-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridine-3-carboxamide
CAS: 1816331-63-1
CID: 91864709
Formula: C28H28FN5O3
MW: 501.6
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight501.6
XLogP33.1
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count5
Rotatable Bond Count6
Exact Mass501.21761793
Monoisotopic Mass501.21761793
Topological Polar Surface Area103 Ų
Heavy Atom Count37
Formal Charge0
Complexity809
Isotope Atom Count0
Defined Atom Stereocenter Count2
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Related Products

CatalogName
M27768-01GSK329
M23742-01GSK121
M11404-01GSK621
M28226-01GSK251
M11407-01GSK343
M11403-01GSK126
M36021-01GSK215
M23936-01GSK620
M37037-01GSK3a-IN-38
M24364-01GSK3i XIII

Alternative Products

CatalogName
BA7849-25GSK321
T73929-01(S, S) -GSK321
MBS5815969(S,S)-GSK321
HY-128888-01(R, R) -GSK321
HY-128888B-01(S, R) -GSK321

Popular Products