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Rociclovir structure
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Rociclovir

TL;DR: Rociclovir (CAS 108436-80-2) is a chemical compound with molecular formula C15H25N5O3 and molecular weight 323.19574 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

9-[1,3-di(propan-2-yloxy)propan-2-yloxymethyl]purin-2-amine

Also Known As: Rociclovir, Rociclovirum, Rociclovir [INN], Rociclovirum [INN-Latin], Hoe 602

CAS Number
108436-80-2
Molecular Formula
C15H25N5O3
Molecular Weight
323.19574 g/mol
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Application Areas

Top 5 of 7 IPC patent classification(s) from the SureChEMBL global patent database.

Agrochemicals (2 patents) Analytical Reagents (4 patents) Biotechnology (71 patents) Heterocyclic Building Blocks (22 patents) Organic Building Blocks (4 patents)

Technical Specifications

Molecular FormulaC15H25N5O3
Molecular Weight323.19574 g/mol
XLogP1.0
Topological Polar Surface Area (TPSA)97.3 Ų
Hydrogen Bond Donors1
Hydrogen Bond Acceptors7
Rotatable Bonds9
Exact Mass323.19574 Da
Heavy Atoms23
Complexity333.0
SMILESCC(C)OCC(COC(C)C)OCN1C=NC2=CN=C(N=C21)N
InChIKeyFBHWXSOQXQBXER-UHFFFAOYSA-N

Chemical Property Profile of Rociclovir

XLogP
1.0
TPSA (Topological Polar Surface Area)
97.3
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
7
Rotatable Bonds
9
Heavy Atoms
23
Complexity
333.0
Exact Mass
323.19574
Monoisotopic Mass
323.19574
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 Rociclovir

The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Rociclovir. The TPSA of 97.3 Ų falls within the moderate polarity range, balancing permeability and solubility for Rociclovir. Following Lipinski's Rule of Five, Rociclovir has 1 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of Rociclovir?

The CAS number of Rociclovir is 108436-80-2.

What is the molecular formula of Rociclovir?

The molecular formula of Rociclovir is C15H25N5O3.

What is the molecular weight of Rociclovir?

The molecular weight of Rociclovir is 323.19574 g/mol.

Where can I buy Rociclovir?

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

Does CoreyChem offer custom synthesis for Rociclovir?

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

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