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RYL-552S

CAT: 0013-GTR19185995-01Size: 25 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19185995-01Size:25 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
RYL-552S is a small molecule active against drug-resistant Plasmodium falciparum, demonstrating potent in vitro efficacy against the asexual blood stage. It serves as a valuable research tool for antimalarial drug discovery, particularly for studying mechanisms of resistance and evaluating compound activity in cellular assays.
CAS Number
1801444-69-8
Field of Research
Infectious Disease & Virology
Smiles
CC1=C (NC=2C (C1=O) =C (F) C=CC2) C3=CC=C (CC4=CC=C (SC (F) (F) F) C=C4) C=C3
Molecular Formula
C24H17F4NOS
Molecular Weight
443.46
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

CID 137647859
CAS Number1801444-69-8
PubChem CID137647859
IUPAC Name5-fluoro-3-methyl-2-[4-[[4-(trifluoromethylsulfanyl)phenyl]methyl]phenyl]-1H-quinolin-4-one
Molecular FormulaC24H17F4NOS
Molecular Weight443.5
XLogP7.3
Topological Polar Surface Area54.4
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count7
Rotatable Bond Count4
Heavy Atom Count31
Formal Charge0
Complexity678
SMILES
CC1=C(NC2=C(C1=O)C(=CC=C2)F)C3=CC=C(C=C3)CC4=CC=C(C=C4)SC(F)(F)F
InChI
InChI=1S/C24H17F4NOS/c1-14-22(29-20-4-2-3-19(25)21(20)23(14)30)17-9-5-15(6-10-17)13-16-7-11-18(12-8-16)31-24(26,27)28/h2-12H,13H2,1H3,(H,29,30)
InChIKey
FGVWBGSMONDTRE-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of CID 137647859
CAS: 1801444-69-8
CID: 137647859
Formula: C24H17F4NOS
MW: 443.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight443.5
XLogP37.3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count7
Rotatable Bond Count4
Exact Mass443.09669799
Monoisotopic Mass443.09669799
Topological Polar Surface Area54.4 Ų
Heavy Atom Count31
Formal Charge0
Complexity678
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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