Products 2103278-86-8

CAS 2103278-86-8 appears in our catalog under these names: Bofutrelvir/ 99.92% (existing batch purity), MPro Inhibitor 11a, Mpro inhibitor 11a, N-((S)-3-Cyclohexyl-1-oxo-1-(((S)-1-oxo-3-((S)-2-oxopyrrolidin-3-yl)propan-2-yl)amino)propan-2-yl)-1H-indole-2-carboxamide, 99.92% ,, 99.92% ,, Bofutrelvir, 96.0%. Offered by: TargetMol, GLPBio, Biosynth, Chemat, MedChemExpress. Available pack sizes: 1mg, 5mg, 10mg, 25mg, 50mg, 100mg, 1 mg.

Bofutrelvir/ 99.92% (existing batch purity)
TargetMol
  • size: 1mg, 5mg, 10mg, 25mg
  • Variants: 6
from 1448.25
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MPro Inhibitor 11a
GLPBio
  • size: 1mg, 10mg, 5mg
  • Variants: 3
from 934.04
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Mpro inhibitor 11a
Biosynth
  • size: 25mg, 10mg, 50mg
  • Variants: 3
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N-((S)-3-Cyclohexyl-1-oxo-1-(((S)-1-oxo-3-((S)-2-oxopyrrolidin-3-yl)propan-2-yl)amino)propan-2-yl)-1H-indole-2-carboxamide, 99.92% ,, 99.92% ,
Chemat
  • size: 1mg, 5mg, 10mg, 25mg
  • Variants: 6
from 1451.60
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Bofutrelvir, 96.0%
MedChemExpress
  • size: 1 mg
  • Variants: 1
from 1462.12
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Structural formula: {0} (CAS {1})

N-[(2S)-3-cyclohexyl-1-oxo-1-({(2S)-1-oxo-3-[(3S)-2-oxopyrrolidin-3-yl]propan-2-yl}amino)propan-2-yl]-1H-indole-2-carboxamide is a secondary carboxamide resulting from the formal condensation of the carboxy group of 1H-indole-2-carboxylic acid with the primary amino group of 3-cyclohexyl-N-{(2S)-1-oxo-3-[(3S)-2-oxopyrrolidin-3-yl]propan-2-yl}-L-alaninamide. It is an inhibitor of SARS coronavirus main proteinase and inhibits SARS-CoV-2 replication in cell culture (EC50 = 0.53 M). It has a role as an EC 3.4.22.69 (SARS coronavirus main proteinase) inhibitor and an anticoronaviral agent. It is a secondary carboxamide, an aldehyde, an oligopeptide, an indolecarboxamide and a member of pyrrolidin-2-ones.

Source: ChEBI

Identity
Molecular formulaC25H32N4O4
Molecular weight452.5 g/mol
IUPAC nameN-[(2S)-3-cyclohexyl-1-oxo-1-[[(2S)-1-oxo-3-[(3S)-2-oxopyrrolidin-3-yl]propan-2-yl]amino]propan-2-yl]-1H-indole-2-carboxamide
InChIKeyHPKJGHVHQWJOOT-ZJOUEHCJSA-N
SMILESC1CCC(CC1)C[C@@H](C(=O)N[C@@H](C[C@@H]2CCNC2=O)C=O)NC(=O)C3=CC4=CC=CC=C4N3

Computed by PubChem (NCBI)

Synonyms: Bofutrelvir, Mpro inhibitor 11A, Coronavirus protease 3clpro inhibitor 11A, peptidomimetic aldehydes 11a, bofutrelvir [INN], orb1693098, compound 11a [PMID: 32321856]