Danoprevir

CAS

924302-43-2

Catalog Number

ACM924302432

Category

Other Products

Molecular Weight

717.85

Molecular Formula

C₃₅H₄₈FN₅O₈S

MSDS COA Spec Sheet

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Specification

Canonical SMILES

CC(C)(C)OC(=O)NC1CCCCCC=CC2CC2(NC(=O)C3CC(CN3C1=O)OC(=O)N4CC5=C(C4)C(=CC=C5)F)C(=O)NS(=O)(=O)C6CC6

InChI Key

ZVTDLPBHTSMEJZ-JSZLBQEHSA-N

What is the molecular formula of Danoprevir?

The molecular formula of Danoprevir is C35H46FN5O9S.

When was Danoprevir created and modified?

Danoprevir was created on 2006-10-26 and modified on 2023-12-30.

What is the molecular weight of Danoprevir?

The molecular weight of Danoprevir is 731.8 g/mol.

What is the IUPAC Name of Danoprevir?

The IUPAC Name of Danoprevir is [(1S,4R,6S,7Z,14S,18R)-4-(cyclopropylsulfonylcarbamoyl)-14-[(2-methylpropan-2-yl)oxycarbonylamino]-2,15-dioxo-3,16-diazatricyclo[14.3.0.0 4,6 ]nonadec-7-en-18-yl] 4-fluoro-1,3-dihydroisoindole-2-carboxylate.

What is the InChIKey of Danoprevir?

The InChIKey of Danoprevir is ZVTDLPBHTSMEJZ-JSZLBQEHSA-N.

What is the Canonical SMILES of Danoprevir?

The Canonical SMILES of Danoprevir is CC(C)(C)OC(=O)NC1CCCCCC=CC2CC2(NC(=O)C3CC(CN3C1=O)OC(=O)N4CC5=C(C4)C(=CC=C5)F)C(=O)NS(=O)(=O)C6CC6.

What is the CAS number of Danoprevir?

The CAS number of Danoprevir is 850876-88-9.

What is the XLogP3-AA value of Danoprevir?

The XLogP3-AA value of Danoprevir is 3.3.

What is the ChEMBL ID of Danoprevir?

The ChEMBL ID of Danoprevir is CHEMBL258734.

What is the potential antiviral activity of Danoprevir according to DrugBank?

Danoprevir has antiviral activity against HCV and potential antiviral activity against SARS-CoV-2 by binding to and blocking the activity of related proteases leading to the inhibition of viral replication.

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