Nesbuvir

Base Information

Chemical Name:Nesbuvir
CAS No.:691852-58-1
Deprecated CAS:934014-98-9
Molecular Formula:C22H23FN2O5S
Molecular Weight:446.499
Hs Code.:
UNII:EYK815W3Z8
ChEMBL ID:CHEMBL1092581
DSSTox Substance ID:DTXSID90219225
Metabolomics Workbench ID:144515
NCI Thesaurus Code:C76498
Nikkaji Number:J2.977.278I
Wikidata:Q27096463
Mol file:691852-58-1.mol

Synonyms:HCV 796;HCV-796;HCV796

Suppliers and Price of Nesbuvir

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

Manufacturers and distributors:

Manufacture/Brand
Chemicals and raw materials
Packaging
price

Crysdot
Nesbuvir 98+%
5mg
$ 250.00

ChemScene
Nesbuvir 98.83%
50mg
$ 1800.00

ChemScene
Nesbuvir 98.83%
10mg
$ 492.00

ChemScene
Nesbuvir 98.83%
5mg
$ 355.00

Chemenu
5-cyclopropyl-2-(4-fluorophenyl)-6-(3-hydroxy-1-(methylsulfonyl)propyl)-N-methylbenzofuran-3-carboxamide 98%
10mg
$ 250.00

Chemenu
5-cyclopropyl-2-(4-fluorophenyl)-6-(3-hydroxy-1-(methylsulfonyl)propyl)-N-methylbenzofuran-3-carboxamide 98%
50mg
$ 914.00

ApexBio Technology
Nesbuvir
25mg
$ 770.00

American Custom Chemicals Corporation
HCV-796 95.00%
5MG
$ 575.30

Total 13 raw suppliers

Chemical Property of Nesbuvir

Chemical Property:

PKA:13.88±0.46(Predicted)
PSA：108.23000
Density:1.407
LogP:4.70590
Solubility.:≥22.3 mg/mL in DMSO; insoluble in H2O; ≥97.8 mg/mL in EtOH with gentle warming
XLogP3:2.7
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:7
Exact Mass:446.13117117
Heavy Atom Count:31
Complexity:748

Purity/Quality:

99%, ^*data from raw suppliers

Nesbuvir 98+% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CNC(=O)C1=C(OC2=CC(=C(C=C21)C3CC3)N(CCO)S(=O)(=O)C)C4=CC=C(C=C4)F
Recent ClinicalTrials:A Study Evaluating the Safety and Clinical Activity of HCV-796 in Treatment-Naive and Non-Responder Subjects

Technology Process of Nesbuvir

There total 4 articles about Nesbuvir which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield:

: 1246280-91-0
phosphoric acid ((2R,3S,4R,5R)-5-(3-carbamoyl-[1,2,4]-triazol-1-yl)-3,4-dihydroxy-tetrahydrofuran-2-ylmethyl) ester 2-{[5-cyclopropyl-2-(4-fluorophenyl)-3-methylcarbamoylbenzofuran-6-yl]methanesulfonylamino}ethyl ester

: 691852-58-1
nesbuvir

: 1246280-88-5
2-(N-(5-cyclopropyl-2-(4-fluorophenyl)-3-(methylcarbamoyl)benzofuran-6-yl)methylsulfonamido)ethyl dihydrogen phosphate

: 36791-04-5,66510-90-5
ribavirin

Guidance literature:: With phospholipase D from Streptomyces chromofuscus; at 20 ℃; aq. buffer (TRIS/HCl, pH 9.2); Enzymatic reaction;
DOI:10.1016/j.bmcl.2010.06.156