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Metacavir

CAT: 1410-M34334-02Size: 5 mgDry Ice: NoHazardous: No
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CAT#:1410-M34334-02Size:5 mg
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Description
Metacavir (PNA) is a novel nucleoside reverse transcriptase inhibitor, a deoxyguanosine analog, with anti-hepatitis B virus (HBV) activity and mitochondrial toxicity, which can be used to study HBV infection.
CAS Number
120503-45-9
Stability
≥ 2 years
Purity
>98% (HPLC)
Weight
265.27
Molecular Formula
C11H15N5O3
Notes
Research use only, not for human use.
Receptor
HBV | Reverse Transcriptase

Chemical Information

Metacavir

Metacavir is under investigation in clinical trial NCT02965859 (The Safety and Dose-range Study of Metacavir Enteric-coated Capsules in Patients With Chronic Hepatitis B).

CAS Number120503-45-9
PubChem CID10355487
IUPAC Name[(2S,5R)-5-(2-amino-6-methoxypurin-9-yl)oxolan-2-yl]methanol
Molecular FormulaC11H15N5O3
Molecular Weight265.27
XLogP0.2
Topological Polar Surface Area108
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count7
Rotatable Bond Count3
Heavy Atom Count19
Formal Charge0
Complexity321
SMILES
COC1=NC(=NC2=C1N=CN2[C@H]3CC[C@H](O3)CO)N
InChI
InChI=1S/C11H15N5O3/c1-18-10-8-9(14-11(12)15-10)16(5-13-8)7-3-2-6(4-17)19-7/h5-7,17H,2-4H2,1H3,(H2,12,14,15)/t6-,7+/m0/s1
InChIKey
FJAOCNGVPLTSLD-NKWVEPMBSA-N
Chemical Structure
2D Structure
2D structure of Metacavir
CAS: 120503-45-9
CID: 10355487
Formula: C11H15N5O3
MW: 265.27
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight265.27
XLogP30.2
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count7
Rotatable Bond Count3
Exact Mass265.11748936
Monoisotopic Mass265.11748936
Topological Polar Surface Area108 Ų
Heavy Atom Count19
Formal Charge0
Complexity321
Isotope Atom Count0
Defined Atom Stereocenter Count2
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Alternative Products

CatalogName
BUP02774-01Metacavir

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