3H-1,2,3-三唑并(4,5-d)嘧啶-7-胺
TL;DR: 3H-1,2,3-三唑并(4,5-d)嘧啶-7-胺 (CAS 1123-54-2) is a chemical compound with molecular formula C4H4N6 and molecular weight 136.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3H-1,2,3-三唑并(4,5-d)嘧啶-7-胺
2H-triazolo[4,5-d]pyrimidin-7-amine
Also Known As: 8-Azaadenine, 6-Amino-8-azapurine, Adenine, 8-aza-, 8-Aza-6-aminopurine, 8-aza-adenine
| Molecular Formula | C4H4N6 |
|---|---|
| Molecular Weight | 136.05 g/mol |
| LogP | -0.7 |
| Topological Polar Surface Area | 93.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 0 |
| Exact Mass | 136.04974 |
| Heavy Atoms | 10 |
| Complexity | 127.0 |
Chemical Identifiers
| CAS Number | 1123-54-2 |
|---|---|
| SMILES | C1=NC2=NNN=C2C(=N1)N |
| InChIKey | HRYKDUPGBWLLHO-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 16 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3H-1,2,3-三唑并(4,5-d)嘧啶-7-胺 (CAS 1123-54-2), with molecular formula C4H4N6 and molecular weight 136.05 g/mol. IUPAC: 2H-triazolo[4,5-d]pyrimidin-7-amine.
Chemical Property Profile of 3H-1,2,3-三唑并(4,5-d)嘧啶-7-胺
Property Insights of 3H-1,2,3-三唑并(4,5-d)嘧啶-7-胺
The XLogP value of -0.7 indicates that 3H-1,2,3-三唑并(4,5-d)嘧啶-7-胺 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 93.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 3H-1,2,3-三唑并(4,5-d)嘧啶-7-胺. Following Lipinski's Rule of Five, 3H-1,2,3-三唑并(4,5-d)嘧啶-7-胺 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
Frequently Asked Questions
What is the CAS number of 3H-1,2,3-三唑并(4,5-d)嘧啶-7-胺?
The CAS number of 3H-1,2,3-三唑并(4,5-d)嘧啶-7-胺 is 1123-54-2.
What is the molecular formula of 3H-1,2,3-三唑并(4,5-d)嘧啶-7-胺?
The molecular formula of 3H-1,2,3-三唑并(4,5-d)嘧啶-7-胺 is C4H4N6.
What is the molecular weight of 3H-1,2,3-三唑并(4,5-d)嘧啶-7-胺?
The molecular weight of 3H-1,2,3-三唑并(4,5-d)嘧啶-7-胺 is 136.05 g/mol.
Where can I buy 3H-1,2,3-三唑并(4,5-d)嘧啶-7-胺?
You can request a quote for 3H-1,2,3-三唑并(4,5-d)嘧啶-7-胺 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3H-1,2,3-三唑并(4,5-d)嘧啶-7-胺?
Yes, KEHONG BIO provides custom synthesis services for 3H-1,2,3-三唑并(4,5-d)嘧啶-7-胺 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.