6-Ethoxy-5-nitrosopyrimidine-2,4-diamine
TL;DR: 6-Ethoxy-5-nitrosopyrimidine-2,4-diamine (CAS 88512-99-6) is a chemical compound with molecular formula C6H9N5O2 and molecular weight 183.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-ethoxy-5-nitrosopyrimidine-2,4-diamine
Also Known As: 6-ethoxy-5-nitrosopyrimidine-2,4-diamine, 5-Nitroso-6-ethoxypyrimidine-2,4-diamine, 2,4-Pyrimidinediamine,6-ethoxy-5-nitroso-, 5-nitroso-2,6-diamino-4-ethoxy-pyrimidine, J2.860.077A
| Molecular Formula | C6H9N5O2 |
|---|---|
| Molecular Weight | 183.08 g/mol |
| LogP | 0.1 |
| Topological Polar Surface Area | 116.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 2 |
| Exact Mass | 183.07562 |
| Heavy Atoms | 13 |
| Complexity | 178.0 |
Chemical Identifiers
| CAS Number | 88512-99-6 |
|---|---|
| SMILES | CCOC1=NC(=NC(=C1N=O)N)N |
| InChIKey | VUTARFHXVDMWDZ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
6-Ethoxy-5-nitrosopyrimidine-2,4-diamine (CAS 88512-99-6), with molecular formula C6H9N5O2 and molecular weight 183.08 g/mol. IUPAC: 6-ethoxy-5-nitrosopyrimidine-2,4-diamine.
Chemical Property Profile of 6-Ethoxy-5-nitrosopyrimidine-2,4-diamine
Property Insights of 6-Ethoxy-5-nitrosopyrimidine-2,4-diamine
The XLogP value of 0.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-Ethoxy-5-nitrosopyrimidine-2,4-diamine. The TPSA of 116.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-Ethoxy-5-nitrosopyrimidine-2,4-diamine. Following Lipinski's Rule of Five, 6-Ethoxy-5-nitrosopyrimidine-2,4-diamine has 2 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 6-Ethoxy-5-nitrosopyrimidine-2,4-diamine?
The CAS number of 6-Ethoxy-5-nitrosopyrimidine-2,4-diamine is 88512-99-6.
What is the molecular formula of 6-Ethoxy-5-nitrosopyrimidine-2,4-diamine?
The molecular formula of 6-Ethoxy-5-nitrosopyrimidine-2,4-diamine is C6H9N5O2.
What is the molecular weight of 6-Ethoxy-5-nitrosopyrimidine-2,4-diamine?
The molecular weight of 6-Ethoxy-5-nitrosopyrimidine-2,4-diamine is 183.08 g/mol.
Where can I buy 6-Ethoxy-5-nitrosopyrimidine-2,4-diamine?
You can request a quote for 6-Ethoxy-5-nitrosopyrimidine-2,4-diamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-Ethoxy-5-nitrosopyrimidine-2,4-diamine?
Yes, KEHONG BIO provides custom synthesis services for 6-Ethoxy-5-nitrosopyrimidine-2,4-diamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.