Leritrelvir

CAT: 0013-GTR19212432-02Size: 10 mgDry Ice: NoHazardous: No

1 / 1

CAT#:0013-GTR19212432-02Size:10 mg

Selected

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

Quick Request Actions

Description

Leritrelvir (RAY1216) is a potent, orally bioavailable SARS-CoV-2 main protease (Mpro) inhibitor. It functions by blocking the cleavage of viral polyproteins, thereby suppressing viral replication. This small molecule is a valuable research tool for in vitro antiviral assays and in vivo studies exploring therapeutic interventions against COVID-19.

CAS Number

2923310-64-7

Product Name Alternative

SARSCoV, SARS-CoV-2, RAY 1216, RAY1216

Field of Research

Infectious Disease & Virology

Purity

97.42% (May vary between batches)

Smiles

C (N[C@@H] (C[C@H]1C (=O) NCC1) C (C (NC2CCCC2) =O) =O) (=O) [C@H]3N (C ([C@@H] (NC (C (F) (F) F) =O) [C@H]4CCCCC4) =O) C[C@]5 ([C@@]3 (CCC5) [H]) [H]

Molecular Formula

C31H44F3N5O6

Molecular Weight

639.71

Storage Conditions

-20°C

Notes

For research use only.

Chemical Information

Leritrelvir

CAS Number	2923310-64-7
PubChem CID	167713195
IUPAC Name	(3S,3aS,6aR)-2-[(2S)-2-cyclohexyl-2-[(2,2,2-trifluoroacetyl)amino]acetyl]-N-[(2S)-4-(cyclopentylamino)-3,4-dioxo-1-[(3S)-2-oxopyrrolidin-3-yl]butan-2-yl]-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrole-3-carboxamide
Molecular Formula	C31H44F3N5O6
Molecular Weight	639.7
XLogP	3.6
Topological Polar Surface Area	154
Hydrogen Bond Donor Count	4
Hydrogen Bond Acceptor Count	9
Rotatable Bond Count	10
Heavy Atom Count	45
Formal Charge	0
Complexity	1170

SMILES

C1CCC(CC1)[C@@H](C(=O)N2C[C@@H]3CCC[C@@H]3[C@H]2C(=O)N[C@@H](C[C@@H]4CCNC4=O)C(=O)C(=O)NC5CCCC5)NC(=O)C(F)(F)F

InChI

InChI=1S/C31H44F3N5O6/c32-31(33,34)30(45)38-23(17-7-2-1-3-8-17)29(44)39-16-19-9-6-12-21(19)24(39)27(42)37-22(15-18-13-14-35-26(18)41)25(40)28(43)36-20-10-4-5-11-20/h17-24H,1-16H2,(H,35,41)(H,36,43)(H,37,42)(H,38,45)/t18-,19-,21-,22-,23-,24-/m0/s1

InChIKey

ICGMMLTUQDVAST-HEZDJTGRSA-N

Chemical Structure

2D Structure

CAS: 2923310-64-7

CID: 167713195

Formula: C31H44F3N5O6

MW: 639.7

Interactive 3D Structure

Loading 3D structure...

View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	639.7
XLogP3	3.6
Hydrogen Bond Donor Count	4
Hydrogen Bond Acceptor Count	9
Rotatable Bond Count	10
Exact Mass	639.32436863
Monoisotopic Mass	639.32436863
Topological Polar Surface Area	154 Å²
Heavy Atom Count	45
Formal Charge	0
Complexity	1170
Isotope Atom Count	0
Defined Atom Stereocenter Count	6
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Alternative Products

Catalog	Name
MBS5815270	Leritrelvir

Leritrelvir

Chemical Information

Alternative Products

Popular Products