Home Other Building Blocks Merimepodib

Merimepodib

CAS No.:
198821-22-6
Catalog Number:
AG002BQF
Molecular Formula:
C23H24N4O6
Molecular Weight:
452.4599
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
5mg
99%
1 week
United States
$214
- +
10mg
99%
1 week
United States
$335
- +
50mg
99%
1 week
United States
$960
- +
100mg
99%
1 week
United States
$1376
- +
Product Description
Catalog Number:
AG002BQF
Chemical Name:
Merimepodib
CAS Number:
198821-22-6
Molecular Formula:
C23H24N4O6
Molecular Weight:
452.4599
MDL Number:
MFCD09837807
IUPAC Name:
[(3S)-oxolan-3-yl] N-[[3-[[3-methoxy-4-(1,3-oxazol-5-yl)phenyl]carbamoylamino]phenyl]methyl]carbamate
InChI:
InChI=1S/C23H24N4O6/c1-30-20-10-17(5-6-19(20)21-12-24-14-32-21)27-22(28)26-16-4-2-3-15(9-16)11-25-23(29)33-18-7-8-31-13-18/h2-6,9-10,12,14,18H,7-8,11,13H2,1H3,(H,25,29)(H2,26,27,28)/t18-/m0/s1
InChI Key:
JBPUGFODGPKTDW-SFHVURJKSA-N
SMILES:
COc1cc(ccc1c1cnco1)NC(=O)Nc1cccc(c1)CNC(=O)O[C@@H]1COCC1
UNII:
2ZL2BA06FU
Properties
Complexity:
652  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
1  
Defined Bond Stereocenter Count:
0
Exact Mass:
452.17g/mol
Formal Charge:
0
Heavy Atom Count:
33  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
452.467g/mol
Monoisotopic Mass:
452.17g/mol
Rotatable Bond Count:
8  
Topological Polar Surface Area:
124A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1  
Literature
Title Journal
Merimepodib, pegylated interferon, and ribavirin in genotype 1 chronic hepatitis C pegylated interferon and ribavirin nonresponders. Hepatology (Baltimore, Md.) 20091201
Ribavirin analogs. Clinics in liver disease 20090801
Phase 2 study of the combination of merimepodib with peginterferon-alpha2b, and ribavirin in nonresponders to previous therapy for chronic hepatitis C. Journal of hepatology 20071001
Understanding the degradation pathway of a poorly water-soluble drug formulated in PEG-400. Journal of pharmaceutical and biomedical analysis 20070411
Low molecular weight indole fragments as IMPDH inhibitors. Bioorganic & medicinal chemistry letters 20060501
A randomized, double-blind, placebo-controlled dose-escalation trial of merimepodib (VX-497) and interferon-alpha in previously untreated patients with chronic hepatitis C. Antiviral therapy 20050101
Regulation of inosine monophosphate dehydrogenase type I and type II isoforms in human lymphocytes. Biochemical pharmacology 20040215
3-cyanoindole-based inhibitors of inosine monophosphate dehydrogenase: synthesis and initial structure-activity relationships. Bioorganic & medicinal chemistry letters 20031020
Inhibitors of inosine monophosphate dehydrogenase: SARs about the N-[3-Methoxy-4-(5-oxazolyl)phenyl moiety. Bioorganic & medicinal chemistry letters 20030616
The effect of ribavirin and IMPDH inhibitors on hepatitis C virus subgenomic replicon RNA. Virology 20030605
Discovery of N-[2-[2-[[3-methoxy-4-(5-oxazolyl)phenyl]amino]-5-oxazolyl]phenyl]-N-methyl-4- morpholineacetamide as a novel and potent inhibitor of inosine monophosphate dehydrogenase with excellent in vivo activity. Journal of medicinal chemistry 20020523
VX-497: a novel, selective IMPDH inhibitor and immunosuppressive agent. Journal of pharmaceutical sciences 20010501
Current and future therapies of hepatitis C. Clinics in liver disease 20010501
New dermatological agents for the treatment of psoriasis. Journal of medicinal chemistry 20010201
The novel IMPDH inhibitor VX-497 prolongs skin graft survival and improves graft versus host disease in mice. Drugs under experimental and clinical research 20010101
Broad-spectrum antiviral activity of the IMP dehydrogenase inhibitor VX-497: a comparison with ribavirin and demonstration of antiviral additivity with alpha interferon. Antimicrobial agents and chemotherapy 20000401
Novel approaches to the treatment of hepatitis C virus infection. Antiviral chemistry & chemotherapy 20000301
Properties