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Details

Stereochemistry ACHIRAL
Molecular Formula C18H14F3N3O2S
Molecular Weight 393.383
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of MMV-048

SMILES

CS(=O)(=O)C1=CC=C(C=C1)C2=CC(C3=CC=C(N=C3)C(F)(F)F)=C(N)N=C2

InChI

InChIKey=RTJQABCNNLMCJF-UHFFFAOYSA-N
InChI=1S/C18H14F3N3O2S/c1-27(25,26)14-5-2-11(3-6-14)13-8-15(17(22)24-10-13)12-4-7-16(23-9-12)18(19,20)21/h2-10H,1H3,(H2,22,24)

HIDE SMILES / InChI

Molecular Formula C18H14F3N3O2S
Molecular Weight 393.383
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Targets

Targets

Primary TargetPharmacologyConditionPotency
Target ID: Uniprot: Q8I406 (Phosphatidylinositol 4-kinase)
PubMed

PubMed

TitleDatePubMed
3,5-Diaryl-2-aminopyridines as a novel class of orally active antimalarials demonstrating single dose cure in mice and clinical candidate potential.
2012 Apr 12
Synthesis of 4-aminoquinoline-pyrimidine hybrids as potent antimalarials and their mode of action studies.
2013 Aug
Cell-based medicinal chemistry optimization of high throughput screening hits for orally active antimalarials. Part 2: hits from SoftFocus kinase and other libraries.
2013 Oct 24
Patents
Substance Class Chemical
Created
by admin
on Sat Dec 16 18:31:39 GMT 2023
Edited
by admin
on Sat Dec 16 18:31:39 GMT 2023
Record UNII
0Z5T00JJ10
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
MMV-048
Code English
5-(4-(METHYLSULFONYL)PHENYL)-6'-(TRIFLUOROMETHYL)-3,3'-BIPYRIDINE-2-AMINE
Systematic Name English
3-(2-(TRIFLUOROMETHYL)PYRIDIN-5-YL)-5-(4-(METHYLSULFONYL)-PHENYL)PYRIDIN-2-AMINE
Systematic Name English
(3,3'-BIPYRIDIN)-2-AMINE, 5-(4-(METHYLSULFONYL)PHENYL)-6'-(TRIFLUOROMETHYL)-
Systematic Name English
J3.367.891F
Code English
MMV-390048
Code English
MMV048
Code English
Code System Code Type Description
FDA UNII
0Z5T00JJ10
Created by admin on Sat Dec 16 18:31:40 GMT 2023 , Edited by admin on Sat Dec 16 18:31:40 GMT 2023
PRIMARY
PUBCHEM
53311393
Created by admin on Sat Dec 16 18:31:40 GMT 2023 , Edited by admin on Sat Dec 16 18:31:40 GMT 2023
PRIMARY
CAS
1314883-11-8
Created by admin on Sat Dec 16 18:31:40 GMT 2023 , Edited by admin on Sat Dec 16 18:31:40 GMT 2023
PRIMARY
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TARGET ORGANISM->INHIBITOR
Whole-cell blood stage activity of UCT943 against a panel of resistant P. falciparum strains to determine potential for cross-resistance compared with MMV048, chloroquine (CQ) and artesunate (AS)
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