brecanavir

Also known as BCV

Brecanavir (INN; codenamed GW640385) is a protease inhibitor which has been studied for the treatment of HIV.

In the Vinony graph

Within Vinony's link graph, brecanavir is referenced by 126 other articles, and connects out to tenofovir alafenamide, nucleoside analogue and medication.

It is catalogued under topics including Abandoned drugs, Benzodioxoles and Carbamates.

Its subject is documented across 5 Wikipedia language editions.

Formula: C33H41N3O10S2
Molecular weight: 703.8 g/mol
IUPAC name: [(3aS,4R,6aR)-2,3,3a,4,5,6a-hexahydrofuro[2,3-b]furan-4-yl] N-[(2S,3R)-4-[1,3-benzodioxol-5-ylsulfonyl(2-methylpropyl)amino]-3-hydroxy-1-[4-[(2-methyl-1,3-thiazol-4-yl)methoxy]phenyl]butan-2-yl]carbamate
SMILES: CC1=NC(=CS1)COC2=CC=C(C=C2)C[C@@H]([C@@H](CN(CC(C)C)S(=O)(=O)C3=CC4=C(C=C3)OCO4)O)NC(=O)O[C@H]5CO[C@@H]6[C@H]5CCO6
InChIKey: JORVRJNILJXMMG-OLNQLETPSA-N
XLogP: 4.4
Polar surface area: 192 Å²
H-bond donors: 2
H-bond acceptors: 13
Formal charge: 0

via PubChem

via ChEMBL · EBI

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chemical formula: C₃₃H₄₁N₃O₁₀S₂
canonical SMILES: CC1=NC(=CS1)COC2=CC=C(C=C2)CC(C(CN(CC(C)C)S(=O)(=O)C3=CC4=C(C=C3)OCO4)O)NC(=O)OC5COC6C5CCO6
isomeric SMILES: CC1=NC(=CS1)COC2=CC=C(C=C2)C[C@@H]([C@@H](CN(CC(C)C)S(=O)(=O)C3=CC4=C(C=C3)OCO4)O)NC(=O)O[C@H]5CO[C@@H]6[C@H]5CCO6

Sources (2)

via Wikidata · CC0

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