RYL-552S

CAT: 0931-T62600-02Size: 50 mgDry Ice: NoHazardous: No

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CAT#:0931-T62600-02Size:50 mg

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24/48H Stock Items & 2 to 6 Weeks non Stock Items.

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CAS Number

1801444-69-8

Target

Others, Parasite

Related Pathways

Microbiology/Virology, Others

Bioactivity

RYL-552S is a drug-resistant strain of Plasmodium falciparum that effectively kills the asexual blood stage of the parasite in vitro.

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

Shipping Conditions

Ice Packs

Storage Temperature

-20°C

Chemical Information

CID 137647859

CAS Number	1801444-69-8
PubChem CID	137647859
IUPAC Name	5-fluoro-3-methyl-2-[4-[[4-(trifluoromethylsulfanyl)phenyl]methyl]phenyl]-1H-quinolin-4-one
Molecular Formula	C24H17F4NOS
Molecular Weight	443.5
XLogP	7.3
Topological Polar Surface Area	54.4
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	7
Rotatable Bond Count	4
Heavy Atom Count	31
Formal Charge	0
Complexity	678

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

CAS: 1801444-69-8

CID: 137647859

Formula: C24H17F4NOS

MW: 443.5

Interactive 3D Structure

Loading 3D structure...

View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	443.5
XLogP3	7.3
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	7
Rotatable Bond Count	4
Exact Mass	443.09669799
Monoisotopic Mass	443.09669799
Topological Polar Surface Area	54.4 Å²
Heavy Atom Count	31
Formal Charge	0
Complexity	678
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

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Alternative Products

Catalog	Name
BA2161-10	RYL-552S
HY-128660	RYL-634
BA2128-10	RYL-552
AR170700-01	RYL 634
YP-W101962-01	Rat ryl Hydrocarbon Receptor (AhR) ELISA Kit

RYL-552S

Chemical Information

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