Balapiravir HydrochlorideProduct ingredient for Balapiravir
- Name
- Balapiravir Hydrochloride
- Drug Entry
- Balapiravir
Balapiravir has been used in trials studying the treatment of Dengue and Hepatitis C, Chronic.
- Accession Number
- DBSALT002171
- Structure
Structure for Balapiravir Hydrochloride (DBSALT002171)
- Synonyms
- Not Available
- UNII
- C860V13650
- CAS Number
- 690270-65-6
- Weight
- Average: 530.96
Monoisotopic: 530.1891897 - Chemical Formula
- C21H31ClN6O8
- InChI Key
- RAJFQMDUVDHLII-PYZPAVLJSA-N
- InChI
- InChI=1S/C21H30N6O8.ClH/c1-10(2)17(28)32-9-21(25-26-23)15(34-19(30)12(5)6)14(33-18(29)11(3)4)16(35-21)27-8-7-13(22)24-20(27)31;/h7-8,10-12,14-16H,9H2,1-6H3,(H2,22,24,31);1H/t14-,15+,16-,21-;/m1./s1
- IUPAC Name
- [(2R,3S,4R,5R)-5-(4-amino-2-oxo-1,2-dihydropyrimidin-1-yl)-2-azido-3,4-bis[(2-methylpropanoyl)oxy]oxolan-2-yl]methyl 2-methylpropanoate hydrochloride
- SMILES
- Cl.CC(C)C(=O)OC[C@]1(O[C@H]([C@H](OC(=O)C(C)C)[C@@H]1OC(=O)C(C)C)N1C=CC(N)=NC1=O)N=[N+]=[N-]
- External Links
- ChemSpider
- 17283722
- ChEMBL
- CHEMBL2105678
- Predicted Properties
Property Value Source Water Solubility 0.0875 mg/mL ALOGPS logP 2.48 ALOGPS logP 2.89 Chemaxon logS -3.8 ALOGPS pKa (Strongest Acidic) 19.22 Chemaxon pKa (Strongest Basic) -0.23 Chemaxon Physiological Charge 0 Chemaxon Hydrogen Acceptor Count 9 Chemaxon Hydrogen Donor Count 1 Chemaxon Polar Surface Area 176.25 Å2 Chemaxon Rotatable Bond Count 12 Chemaxon Refractivity 117.36 m3·mol-1 Chemaxon Polarizability 48.88 Å3 Chemaxon Number of Rings 2 Chemaxon Bioavailability 0 Chemaxon Rule of Five No Chemaxon Ghose Filter No Chemaxon Veber's Rule No Chemaxon MDDR-like Rule No Chemaxon