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N 0861 structure
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N 0861

TL;DR: N 0861 (CAS 141696-90-4) is a chemical compound with molecular formula C13H17N5 and molecular weight 243.14839 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

N-[(1S,2R,4R)-2-bicyclo[2.2.1]heptanyl]-9-methylpurin-6-amine

Also Known As: N-0861, N(6)-Endonorbornan-2-yl-9-methyladenine, N 0861, N-[(1S,2R,4R)-2-bicyclo[2.2.1]heptanyl]-9-methylpurin-6-amine, N-(Bicyclo[2.2.1]heptan-2-yl)-9-methyl-9H-purin-6-amine

CAS Number
141696-90-4
Molecular Formula
C13H17N5
Molecular Weight
243.14839 g/mol
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Application Areas

Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.

Heterocyclic Building Blocks (1 patents) Pharmaceutical Intermediates (1 patents)

Technical Specifications

Molecular FormulaC13H17N5
Molecular Weight243.14839 g/mol
XLogP2.4
Topological Polar Surface Area (TPSA)55.6 Ų
Hydrogen Bond Donors1
Hydrogen Bond Acceptors4
Rotatable Bonds2
Exact Mass243.14839 Da
Heavy Atoms18
Complexity323.0
SMILESCN1C=NC2=C(N=CN=C21)N[C@@H]3C[C@@H]4CC[C@H]3C4
InChIKeyMTQYIGCUBBMQCJ-KXUCPTDWSA-N

Chemical Property Profile of N 0861

XLogP
2.4
TPSA (Topological Polar Surface Area)
55.6
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
4
Rotatable Bonds
2
Heavy Atoms
18
Complexity
323.0
Exact Mass
243.14839
Monoisotopic Mass
243.14839
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 N 0861

The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N 0861. With a topological polar surface area (TPSA) of 55.6 Ų, N 0861 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N 0861 has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of N 0861?

The CAS number of N 0861 is 141696-90-4.

What is the molecular formula of N 0861?

The molecular formula of N 0861 is C13H17N5.

What is the molecular weight of N 0861?

The molecular weight of N 0861 is 243.14839 g/mol.

Where can I buy N 0861?

You can request a quote for N 0861 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for N 0861?

Yes, CoreyChem provides custom synthesis services for N 0861 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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