4-(Hydroxy(oxido)amino)-5-mercapto-1H-imidazole
TL;DR: 4-(Hydroxy(oxido)amino)-5-mercapto-1H-imidazole (CAS 6963-64-0) is a chemical compound with molecular formula C3H3N3O2S and molecular weight 144.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-nitro-1H-imidazole-4-thiol
Also Known As: 4-nitro-1H-imidazole-5-thiol, 5-nitro-1H-imidazole-4-thiol, 4-mercapto-5-nitroimidazole, 5-mercapto-4-nitroimidazole, 1H-Imidazole-5-thiol, 4-nitro-
| Molecular Formula | C3H3N3O2S |
|---|---|
| Molecular Weight | 144.99 g/mol |
| LogP | 0.6066 |
| Topological Polar Surface Area | 71.82 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 144.9946 |
| Heavy Atoms | 9 |
| Complexity | 232.71666 |
Chemical Identifiers
| CAS Number | 6963-64-0 |
|---|---|
| SMILES | C1=NC(=C(N1)[N+](=O)[O-])S |
Product Overview
4-(Hydroxy(oxido)amino)-5-mercapto-1H-imidazole (CAS 6963-64-0), with molecular formula C3H3N3O2S and molecular weight 144.99 g/mol. IUPAC: 5-nitro-1H-imidazole-4-thiol.
Chemical Property Profile of 4-(Hydroxy(oxido)amino)-5-mercapto-1H-imidazole
Property Insights of 4-(Hydroxy(oxido)amino)-5-mercapto-1H-imidazole
The XLogP value of 0.6066 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(Hydroxy(oxido)amino)-5-mercapto-1H-imidazole. The TPSA of 71.82 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(Hydroxy(oxido)amino)-5-mercapto-1H-imidazole. Following Lipinski's Rule of Five, 4-(Hydroxy(oxido)amino)-5-mercapto-1H-imidazole has 2 hydrogen bond donor(s) and 4 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-(Hydroxy(oxido)amino)-5-mercapto-1H-imidazole?
The CAS number of 4-(Hydroxy(oxido)amino)-5-mercapto-1H-imidazole is 6963-64-0.
What is the molecular formula of 4-(Hydroxy(oxido)amino)-5-mercapto-1H-imidazole?
The molecular formula of 4-(Hydroxy(oxido)amino)-5-mercapto-1H-imidazole is C3H3N3O2S.
What is the molecular weight of 4-(Hydroxy(oxido)amino)-5-mercapto-1H-imidazole?
The molecular weight of 4-(Hydroxy(oxido)amino)-5-mercapto-1H-imidazole is 144.99 g/mol.
Where can I buy 4-(Hydroxy(oxido)amino)-5-mercapto-1H-imidazole?
You can request a quote for 4-(Hydroxy(oxido)amino)-5-mercapto-1H-imidazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(Hydroxy(oxido)amino)-5-mercapto-1H-imidazole?
Yes, KEHONG BIO provides custom synthesis services for 4-(Hydroxy(oxido)amino)-5-mercapto-1H-imidazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.