WARNING: This product is for research use only, not for human or veterinary use.
MedKoo CAT#: 562210
CAS#: 1428569-85-0
Description: GDC-0339 is a bioavailable and efficacious PIM inhibitor for multiple myeloma.
MedKoo Cat#: 562210
Name: GDC-0339
CAS#: 1428569-85-0
Chemical Formula: C20H22F3N7OS
Exact Mass: 465.1559
Molecular Weight: 465.49
Elemental Analysis: C, 51.60; H, 4.76; F, 12.24; N, 21.06; O, 3.44; S, 6.89
Synonym: GDC-0339; GDC 0339; GDC0339;
IUPAC/Chemical Name: 5-Amino-N-(5-((4R,5R)-4-amino-5-fluoroazepan-1-yl)-1-methyl-1H-pyrazol-4-yl)-2-(2,6-difluorophenyl)thiazole-4-carboxamide
InChi Key: NHXVGMQFCYBLTL-ZWNOBZJWSA-N
InChi Code: InChI=1S/C20H22F3N7OS/c1-29-20(30-7-5-10(21)13(24)6-8-30)14(9-26-29)27-18(31)16-17(25)32-19(28-16)15-11(22)3-2-4-12(15)23/h2-4,9-10,13H,5-8,24-25H2,1H3,(H,27,31)/t10-,13-/m1/s1
SMILES Code: O=C(C1=C(N)SC(C2=C(F)C=CC=C2F)=N1)NC3=C(N4CC[C@@H](N)[C@H](F)CC4)N(C)N=C3
1: Takahashi RH, Wang X, Segraves NL, Wang J, Chang JH, Khojasteh SC, Ma S. CYP1A1-Mediated Intramolecular Rearrangement of Aminoazepane in GDC-0339. Drug Metab Dispos. 2017 Oct;45(10):1084-1092. doi: 10.1124/dmd.117.076786. Epub 2017 Aug 8. PubMed PMID: 28790146.