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Vaniprevir chemical structure, C38H55N5O9S, CAS 923590-37-8
2D chemical structure

Key facts

What buyers check first

CAS number
923590-37-8
Formula
C38H55N5O9S
Molar mass
757.95 g/mol
EC number
682-506-7
HS code
293590
Category
Antibiotics and anti-infectives

What is Vaniprevir?

Plain description, key identifiers and synonyms

Vaniprevir is a chemical substance with the molecular formula C38H55N5O9S and a molar mass of 757.95 g/mol. Its CAS registry number is 923590-37-8. The IUPAC name is (1R,21S,24S)-21-tert-butyl-N-[(1R,2R)-1-(cyclopropylsulfonylcarbamoyl)-2-ethylcyclopropyl]-16,16-dimethyl-3,19,22-trioxo-2,18-dioxa-4,20,23-triazatetracyclo[21.2.1.14,7.06,11]heptacosa-6(11),7,9-triene-24-carboxamide.

Identifiers

Registry numbers, names and line notations, tap to copy

IUPAC name
(1R,21S,24S)-21-tert-butyl-N-[(1R,2R)-1-(cyclopropylsulfonylcarbamoyl)-2-ethylcyclopropyl]-16,16-dimethyl-3,19,22-trioxo-2,18-dioxa-4,20,23-triazatetracyclo[21.2.1.14,7.06,11]heptacosa-6(11),7,9-triene-24-carboxamide
CAS number
923590-37-8 CAS number cross-checked
EC number
682-506-7
Molecular formula
C38H55N5O9S
UNII
CV3X74AO1H
InChIKey
KUQWGLQLLVFLSM-ONAXAZCASA-N
InChI
InChI=1S/C38H55N5O9S/c1-7-25-18-38(25,33(46)41-53(49,50)27-14-15-27)40-31(44)29-17-26-20-43(29)32(45)30(36(2,3)4)39-34(47)51-22-37(5,6)16-9-8-11-23-12-10-13-24-19-42(21-28(23)24)35(48)52-26/h10,12-13,25-27,29-30H,7-9,11,14-22H2,1-6H3,(H,39,47)(H,40,44)(H,41,46)/t25-,26-,29+,30-,38-/m1/s1
Canonical SMILES
CCC1CC1(NC(=O)C1CC2CN1C(=O)C(C(C)(C)C)NC(=O)OCC(C)(C)CCCCc1cccc3c1CN(C3)C(=O)O2)C(=O)NS(=O)(=O)C1CC1
Isomeric SMILES
CC[C@@H]1C[C@@]1(C(=O)NS(=O)(=O)C2CC2)NC(=O)[C@@H]3C[C@@H]4CN3C(=O)[C@@H](NC(=O)OCC(CCCCC5=C6CN(CC6=CC=C5)C(=O)O4)(C)C)C(C)(C)C

Synonyms

  • vanihep
  • MK 7009
  • vaniprevirum
  • 3su6
  • vaniprevir, MK-7009

Physical and chemical properties

Measured values and descriptors computed from the structure

Physical and chemical properties

Measured values, check the supplier specification for your grade

No measured properties are recorded for this substance yet. Ask suppliers for a technical data sheet.

Values vary by grade. Ask suppliers for the COA or TDS of the batch you buy.

Computed descriptors

Calculated from the structure, useful for screening and formulation

Molecular weight
757.95 g/molcalc.
Exact mass
757.372 Dacalc.
LogP (octanol/water)
3.9calc.
Topological polar surface area
180.5 Ųcalc.
Hydrogen bond donors
3calc.
Hydrogen bond acceptors
9calc.
Rotatable bonds
6calc.
Heavy atoms
53calc.
Rings
6calc.
Aromatic rings
1calc.
Fraction sp3 carbons
0.71calc.
Formal charge
0calc.
Stereocentres
5calc.
Lipinski rule of five
Passes (1 violation)calc.

Calculated for screening. Confirm critical figures with the supplier.

Murcko scaffold

The ring system that remains when every side chain is removed

Murcko scaffold of this chemical, O=C1NCC(=O)N2CC(CC2C(=O)NC2(C(=O)NS(=O)(=O)C3CC3)CC2)OC(=O)N2Cc3cccc(c3C2)CCCCCCO1

O=C1NCC(=O)N2CC(CC2C(=O)NC2(C(=O)NS(=O)(=O)C3CC3)CC2)OC(=O)N2Cc3cccc(c3C2)CCCCCCO1

6 rings, 45 atoms.

2 other chemicals share this scaffold

Safety and hazards

GHS classification summary, not a safety data sheet

GHS signal word
Warning
GHS08: Serious health hazard
Serious health hazard

Hazard statements

  • H373May cause damage to organs through prolonged or repeated exposure.
Precautionary statements (3)
  • P260Do not breathe dust, fume, gas, mist, vapours or spray.
  • P319Get medical help if you feel unwell.
  • P501Dispose of contents and container in accordance with local regulations.

GHS classification summary, not a safety data sheet (SDS). Classifications can differ by supplier, grade and concentration. Always check the supplier's SDS.

Full safety data and first aid

Vaniprevir suppliers

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Where suppliers are based

1 supplier in 1 country

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Vaniprevir price

Indicative price range per kg from live supplier offers

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Suppliers quote this chemical on request. Send one free request and compare quotes side by side.

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Uses and applications

What the substance is used for, by industry and function

Industries and functions

Roles

  • antiinfective agent
  • antimicrobial agent
  • antimicrobial drug
  • antiviral agent
  • antiviral drug
  • enzyme inhibitor
  • hepatitis C protease inhibitor
  • pharmaceutical
  • protease inhibitor

Regulatory status

Inventories, regulations and trade controls that list this substance

No regulatory list memberships are recorded for this substance yet. Always check the rules of the importing and exporting country before trade.

HS code and trade data

Customs classification and reported world trade statistics

Global trade

World import and export statistics for the HS code Vaniprevir is traded under.

HS 2935.90Indicative HS code

Sulphonamides, other

World exports in 2024
$5.64B
−11.0% vs 2023, imports $8.56B
2019 to 2024
Top exporters
  1. Ireland43.1%
  2. China12.0%
  3. India * partner reported9.5%
Top importers
  1. United States23.6%
  2. Slovenia19.1%
  3. Spain11.7%

* Partner reported figures, a lower bound.

Reported customs values in USD, not prices.Full trade data

The HS code shown for Vaniprevir is indicative (it was assigned by structure rules). Confirm the classification with your customs broker before shipping.

Frequently asked questions

Quick answers about Vaniprevir, based on the data on this page

What is Vaniprevir?

Vaniprevir is a chemical substance with the molecular formula C38H55N5O9S and a molar mass of 757.95 g/mol. Its CAS registry number is 923590-37-8.

What is the CAS number of Vaniprevir?

The CAS registry number of Vaniprevir is 923590-37-8.

What is the molecular formula and weight of Vaniprevir?

The molecular formula of Vaniprevir is C38H55N5O9S and its molar mass is 757.95 g/mol.

What is Vaniprevir used for?

Known uses and roles of Vaniprevir include antivirals in pharmaceuticals, antiinfective agent, antimicrobial agent, antimicrobial drug, antiviral agent and 5 more.

Is Vaniprevir hazardous?

Vaniprevir carries the GHS signal word "Warning". Main hazards: may cause damage to organs through prolonged or repeated exposure. This summary is not an SDS, always read the supplier safety data sheet.

What is the HS code of Vaniprevir?

Vaniprevir is usually classified under HS code 293590 (Sulphonamides, other). This is indicative, confirm it with your customs broker before shipping.

Where can I buy Vaniprevir?

CompoundList lists 1 supplier of Vaniprevir in Ukraine. Send one free request to get and compare quotes. Your contact details stay private until you accept a quote.

What is the price of Vaniprevir?

Suppliers quote Vaniprevir on request because prices depend on grade, purity, quantity and destination. A free request on CompoundList gets you several quotes to compare.

Guides for buyers

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Data last updated 7 Oct 2026. Details may have changed, please confirm them with the supplier. Report an error on this page
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