Products 1258226-87-7

CAS 1258226-87-7 appears in our catalog under these names: Ombitasvir, Ombitasvir, >95% (HPLC), Ombitasvir/ 98.17% (existing batch purity), Ombitasvir 98%, Ombitasvir, 99.79%. Offered by: Chemat Brand, TRC, TargetMol, Biosynth, Ambeed. Available pack sizes: on request, 10mg, 2,5mg, 25mg, 2mg, 5mg, 50mg, 100mg.

Structural formula: {0} (CAS {1})

Ombitasvir is a dipeptide derivative which is used which is in combination with dasabuvir sodium hydrate, paritaprevir and ritonavir (under the trade name Viekira Pak) for treatment of chronic hepatitis C virus genotype 1 infection as well as cirrhosis of the liver. It has a role as an antiviral drug and a hepatitis C virus nonstructural protein 5A inhibitor. It is a carbamate ester, a member of pyrrolidines, a dipeptide and an aromatic amide. It is functionally related to a Val-Pro.

Source: ChEBI

Identity
Molecular formulaC50H67N7O8
Molecular weight894.1 g/mol
IUPAC namemethyl N-[(2S)-1-[(2S)-2-[[4-[(2S,5S)-1-(4-tert-butylphenyl)-5-[4-[[(2S)-1-[(2S)-2-(methoxycarbonylamino)-3-methylbutanoyl]pyrrolidine-2-carbonyl]amino]phenyl]pyrrolidin-2-yl]phenyl]carbamoyl]pyrrolidin-1-yl]-3-methyl-1-oxobutan-2-yl]carbamate
InChIKeyPIDFDZJZLOTZTM-KHVQSSSXSA-N
SMILESCC(C)[C@@H](C(=O)N1CCC[C@H]1C(=O)NC2=CC=C(C=C2)[C@@H]3CC[C@H](N3C4=CC=C(C=C4)C(C)(C)C)C5=CC=C(C=C5)NC(=O)[C@@H]6CCCN6C(=O)[C@H](C(C)C)NC(=O)OC)NC(=O)OC

Computed by PubChem (NCBI)