4,6-Diamino-2-Mercapto-5-Nitrosopyrimidine
TL;DR: 4,6-Diamino-2-Mercapto-5-Nitrosopyrimidine (CAS 59150-27-5) is a chemical compound with molecular formula C4H5N5OS and molecular weight 171.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,6-diamino-5-nitroso-1H-pyrimidine-2-thione
Also Known As: 4,6-Diamino-2-Mercapto-5-Nitrosopyrimidine, 4,6-diamino-5-nitroso-1H-pyrimidine-2-thione, 2-Mercapto-4,6-diamino-5-nitrosopyrimidine, 4,6-DIAMINO-5-NITROSO-2-THIOPYRIMIDINE, 4,6-Diamino-5-nitroso-2-pyrimidinethiol
| Molecular Formula | C4H5N5OS |
|---|---|
| Molecular Weight | 171.02 g/mol |
| LogP | 0.70149 |
| Topological Polar Surface Area | 110.15 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 1 |
| Exact Mass | 171.02148 |
| Heavy Atoms | 11 |
| Complexity | 318.57593 |
Chemical Identifiers
| CAS Number | 59150-27-5 |
|---|---|
| SMILES | C1(=C(NC(=S)N=C1N)N)N=O |
Product Overview
4,6-Diamino-2-Mercapto-5-Nitrosopyrimidine (CAS 59150-27-5), with molecular formula C4H5N5OS and molecular weight 171.02 g/mol. IUPAC: 4,6-diamino-5-nitroso-1H-pyrimidine-2-thione.
Chemical Property Profile of 4,6-Diamino-2-Mercapto-5-Nitrosopyrimidine
Property Insights of 4,6-Diamino-2-Mercapto-5-Nitrosopyrimidine
The XLogP value of 0.70149 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4,6-Diamino-2-Mercapto-5-Nitrosopyrimidine. The TPSA of 110.15 Ų falls within the moderate polarity range, balancing permeability and solubility for 4,6-Diamino-2-Mercapto-5-Nitrosopyrimidine. Following Lipinski's Rule of Five, 4,6-Diamino-2-Mercapto-5-Nitrosopyrimidine has 3 hydrogen bond donor(s) and 6 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 4,6-Diamino-2-Mercapto-5-Nitrosopyrimidine?
The CAS number of 4,6-Diamino-2-Mercapto-5-Nitrosopyrimidine is 59150-27-5.
What is the molecular formula of 4,6-Diamino-2-Mercapto-5-Nitrosopyrimidine?
The molecular formula of 4,6-Diamino-2-Mercapto-5-Nitrosopyrimidine is C4H5N5OS.
What is the molecular weight of 4,6-Diamino-2-Mercapto-5-Nitrosopyrimidine?
The molecular weight of 4,6-Diamino-2-Mercapto-5-Nitrosopyrimidine is 171.02 g/mol.
Where can I buy 4,6-Diamino-2-Mercapto-5-Nitrosopyrimidine?
You can request a quote for 4,6-Diamino-2-Mercapto-5-Nitrosopyrimidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4,6-Diamino-2-Mercapto-5-Nitrosopyrimidine?
Yes, KEHONG BIO provides custom synthesis services for 4,6-Diamino-2-Mercapto-5-Nitrosopyrimidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.