Aditeren
TL;DR: Aditeren (CAS 56066-19-4) is a chemical compound with molecular formula C13H17N5O2 and molecular weight 275.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[(4-amino-3,5-dimethoxyphenyl)methyl]pyrimidine-2,4-diamine
Also Known As: Aditeren, Aditerene, Aditerena, Aditeren [INN], aditereno
| Molecular Formula | C13H17N5O2 |
|---|---|
| Molecular Weight | 275.14 g/mol |
| LogP | 0.8 |
| Topological Polar Surface Area | 122.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 275.1382 |
| Heavy Atoms | 20 |
| Complexity | 292.0 |
Chemical Identifiers
| CAS Number | 56066-19-4 |
|---|---|
| SMILES | COC1=CC(=CC(=C1N)OC)CC2=CN=C(N=C2N)N |
| InChIKey | WFBZIFZFHLQCPP-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Aditeren (CAS 56066-19-4), with molecular formula C13H17N5O2 and molecular weight 275.14 g/mol. IUPAC: 5-[(4-amino-3,5-dimethoxyphenyl)methyl]pyrimidine-2,4-diamine.
Chemical Property Profile of Aditeren
Property Insights of Aditeren
The XLogP value of 0.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Aditeren. The TPSA of 122.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Aditeren. Following Lipinski's Rule of Five, Aditeren has 3 hydrogen bond donor(s) and 7 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 Aditeren?
The CAS number of Aditeren is 56066-19-4.
What is the molecular formula of Aditeren?
The molecular formula of Aditeren is C13H17N5O2.
What is the molecular weight of Aditeren?
The molecular weight of Aditeren is 275.14 g/mol.
Where can I buy Aditeren?
You can request a quote for Aditeren directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Aditeren?
Yes, KEHONG BIO provides custom synthesis services for Aditeren and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.