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Substance Name: Ipatasertib dihydrochloride
RN: 1396257-94-5
UNII: M2JCB5A8EV
InChIKey: SRKVNRNRVFDUTG-VISIQVHMSA-N

Note

  • NCI: Inpatasertib An orally bioavailable inhibitor of the serine/threonine protein kinase Akt (protein kinase B) with potential antineoplastic activity. Ipatasertib binds to and inhibits the activity of Akt in a non-ATP-competitive manner, which may result in the inhibition of the PI3K/Akt signaling pathway and tumor cell proliferation and the induction of tumor cell apoptosis. Activation of the PI3K/Akt signaling pathway is frequently associated with tumorigenesis and dysregulated PI3K/Akt signaling may contribute to tumor resistance to a variety of antineoplastic agents. (NCI Thesaurus)

Molecular Formula

  • C24-H32-Cl-N5-O2.2Cl-H

Molecular Weight

  • 530.9246
 
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Names and Synonyms

Name of Substance

  • Ipatasertib dihydrochloride

Synonyms

  • 1-Propanone, 2-(4-chlorophenyl)-1-(4-((5R,7R)-6,7-dihydro-7-hydroxy-5-methyl-5H-cyclopentapyrimidin-4-yl)-1-piperazinyl)-3-((1-methylethyl)amino)-, hydrochloride (1:2), (2S)-
  • Ipatasertib dihydrochloride
  • UNII-M2JCB5A8EV

Registry Numbers

CAS Registry Number

  • 1396257-94-5

FDA UNII

  • M2JCB5A8EV

System Generated Number

  • 1396257945

Structure Descriptors

InChI

1S/C24H32ClN5O2.2ClH/c1-15(2)26-13-19(17-4-6-18(25)7-5-17)24(32)30-10-8-29(9-11-30)23-21-16(3)12-20(31)22(21)27-14-28-23;;/h4-7,14-16,19-20,26,31H,8-13H2,1-3H3;2*1H/t16-,19-,20-;;/m1../s1

InChIKey

SRKVNRNRVFDUTG-VISIQVHMSA-N

Smiles

Cl.Cl.CC(C)NC[C@@H](C(=O)N1CCN(CC1)c2ncnc3[C@H](O)C[C@@H](C)c23)c4ccc(Cl)cc4