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1H-1,2,3-Triazolo[4,5-d]pyrimidin-5-amine, 7-chloro- structure
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1H-1,2,3-Triazolo[4,5-d]pyrimidin-5-amine, 7-chloro-

TL;DR: 1H-1,2,3-Triazolo[4,5-d]pyrimidin-5-amine, 7-chloro- (CAS 1135074-15-5) is a chemical compound with molecular formula C4H3ClN6 and molecular weight 170.01077 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

7-chloro-2H-triazolo[4,5-d]pyrimidin-5-amine

Also Known As: 7-chloro-2H-triazolo[4,5-d]pyrimidin-5-amine, 2-amino-6-chloro-8-azapurine, 1H-1,2,3-Triazolo[4,5-d]pyrimidin-5-amine, 7-chloro-, 7-Chloro-3H-[1,2,3]triazolo[4,5-d]pyrimidin-5-amine, PS-J-061

CAS Number
1135074-15-5
Molecular Formula
C4H3ClN6
Molecular Weight
170.01077 g/mol
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Application Areas

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

Heterocyclic Building Blocks (12 patents) Organic Building Blocks (8 patents) Organometallic Reagents (2 patents) Pharmaceutical Intermediates (7 patents)

Technical Specifications

Molecular FormulaC4H3ClN6
Molecular Weight170.01077 g/mol
XLogP0.3
Topological Polar Surface Area (TPSA)93.4 Ų
Hydrogen Bond Donors2
Hydrogen Bond Acceptors5
Rotatable Bonds0
Exact Mass170.01077 Da
Heavy Atoms11
Complexity154.0
SMILESC12=NNN=C1N=C(N=C2Cl)N
InChIKeyHHVGSGWNKPENEQ-UHFFFAOYSA-N

Chemical Property Profile of 1H-1,2,3-Triazolo[4,5-d]pyrimidin-5-amine, 7-chloro-

XLogP
0.3
TPSA (Topological Polar Surface Area)
93.4
Hydrogen Bond Donors
2
Hydrogen Bond Acceptors
5
Rotatable Bonds
0
Heavy Atoms
11
Complexity
154.0
Exact Mass
170.01077
Monoisotopic Mass
170.01077
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 1H-1,2,3-Triazolo[4,5-d]pyrimidin-5-amine, 7-chloro-

The XLogP value of 0.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1H-1,2,3-Triazolo[4,5-d]pyrimidin-5-amine, 7-chloro-. The TPSA of 93.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 1H-1,2,3-Triazolo[4,5-d]pyrimidin-5-amine, 7-chloro-. Following Lipinski's Rule of Five, 1H-1,2,3-Triazolo[4,5-d]pyrimidin-5-amine, 7-chloro- has 2 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 1H-1,2,3-Triazolo[4,5-d]pyrimidin-5-amine, 7-chloro-?

The CAS number of 1H-1,2,3-Triazolo[4,5-d]pyrimidin-5-amine, 7-chloro- is 1135074-15-5.

What is the molecular formula of 1H-1,2,3-Triazolo[4,5-d]pyrimidin-5-amine, 7-chloro-?

The molecular formula of 1H-1,2,3-Triazolo[4,5-d]pyrimidin-5-amine, 7-chloro- is C4H3ClN6.

What is the molecular weight of 1H-1,2,3-Triazolo[4,5-d]pyrimidin-5-amine, 7-chloro-?

The molecular weight of 1H-1,2,3-Triazolo[4,5-d]pyrimidin-5-amine, 7-chloro- is 170.01077 g/mol.

Where can I buy 1H-1,2,3-Triazolo[4,5-d]pyrimidin-5-amine, 7-chloro-?

You can request a quote for 1H-1,2,3-Triazolo[4,5-d]pyrimidin-5-amine, 7-chloro- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for 1H-1,2,3-Triazolo[4,5-d]pyrimidin-5-amine, 7-chloro-?

Yes, CoreyChem provides custom synthesis services for 1H-1,2,3-Triazolo[4,5-d]pyrimidin-5-amine, 7-chloro- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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