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Amitivir structure
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Amitivir

TL;DR: Amitivir (CAS 111393-84-1) is a chemical compound with molecular formula C3H2N4S and molecular weight 126.000015 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

1,3,4-thiadiazol-2-ylcyanamide

Also Known As: Amitivir, amitivirum, Amitivir [INN], 1,3,4-Thiadiazol-2-ylcyanamide, Amitivir [USAN:INN]

CAS Number
111393-84-1
Molecular Formula
C3H2N4S
Molecular Weight
126.000015 g/mol
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Application Areas

Top 5 of 4 IPC patent classification(s) from the SureChEMBL global patent database.

Agrochemicals (4 patents) Biotechnology (2 patents) Heterocyclic Building Blocks (7 patents) Pharmaceutical Intermediates (19 patents)

Technical Specifications

Molecular FormulaC3H2N4S
Molecular Weight126.000015 g/mol
XLogP0.7
Topological Polar Surface Area (TPSA)89.8 Ų
Hydrogen Bond Donors1
Hydrogen Bond Acceptors5
Rotatable Bonds1
Exact Mass126.000015 Da
Heavy Atoms8
Complexity116.0
SMILESC1=NN=C(S1)NC#N
InChIKeyYUCHAYRHHXJNQK-UHFFFAOYSA-N

Chemical Property Profile of Amitivir

XLogP
0.7
TPSA (Topological Polar Surface Area)
89.8
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
5
Rotatable Bonds
1
Heavy Atoms
8
Complexity
116.0
Exact Mass
126.000015
Monoisotopic Mass
126.000015
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

Property Insights of Amitivir

The XLogP value of 0.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Amitivir. The TPSA of 89.8 Ų falls within the moderate polarity range, balancing permeability and solubility for Amitivir. Following Lipinski's Rule of Five, Amitivir has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of Amitivir?

The CAS number of Amitivir is 111393-84-1.

What is the molecular formula of Amitivir?

The molecular formula of Amitivir is C3H2N4S.

What is the molecular weight of Amitivir?

The molecular weight of Amitivir is 126.000015 g/mol.

Where can I buy Amitivir?

You can request a quote for Amitivir directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for Amitivir?

Yes, CoreyChem provides custom synthesis services for Amitivir and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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