(5-Nitrofuran-2-yl)methyl carbamimidothioate hydrobromide
TL;DR: (5-Nitrofuran-2-yl)methyl carbamimidothioate hydrobromide (CAS 82118-18-1) is a chemical compound with molecular formula C6H8BrN3O3S and molecular weight 280.95 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5-nitrofuran-2-yl)methyl carbamimidothioate;hydrobromide
Also Known As: (5-Nitrofuran-2-yl)methyl carbamimidothioate hydrobromide, (5-nitro-2-furyl)methyl aminomethanimidothioate hydrobromide, 2-Amidinothiomethyl-5-nitrofuran hydrobromide, (5-nitrofuran-2-yl)methyl carbamimidothioate;hydrobromide, METHYLAMINOMETHANIMIDOTHIOATEHYDROBROMIDE
| Molecular Formula | C6H8BrN3O3S |
|---|---|
| Molecular Weight | 280.95 g/mol |
| LogP | 1.89237 |
| Topological Polar Surface Area | 106.15 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 280.94696 |
| Heavy Atoms | 14 |
| Complexity | 340.81766 |
Chemical Identifiers
| CAS Number | 82118-18-1 |
|---|---|
| SMILES | C1=C(OC(=C1)[N+](=O)[O-])CSC(=N)N.Br |
Product Overview
(5-Nitrofuran-2-yl)methyl carbamimidothioate hydrobromide (CAS 82118-18-1), with molecular formula C6H8BrN3O3S and molecular weight 280.95 g/mol. IUPAC: (5-nitrofuran-2-yl)methyl carbamimidothioate;hydrobromide.
Chemical Property Profile of (5-Nitrofuran-2-yl)methyl carbamimidothioate hydrobromide
Property Insights of (5-Nitrofuran-2-yl)methyl carbamimidothioate hydrobromide
The XLogP value of 1.89237 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (5-Nitrofuran-2-yl)methyl carbamimidothioate hydrobromide. The TPSA of 106.15 Ų falls within the moderate polarity range, balancing permeability and solubility for (5-Nitrofuran-2-yl)methyl carbamimidothioate hydrobromide. Following Lipinski's Rule of Five, (5-Nitrofuran-2-yl)methyl carbamimidothioate hydrobromide 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 (5-Nitrofuran-2-yl)methyl carbamimidothioate hydrobromide?
The CAS number of (5-Nitrofuran-2-yl)methyl carbamimidothioate hydrobromide is 82118-18-1.
What is the molecular formula of (5-Nitrofuran-2-yl)methyl carbamimidothioate hydrobromide?
The molecular formula of (5-Nitrofuran-2-yl)methyl carbamimidothioate hydrobromide is C6H8BrN3O3S.
What is the molecular weight of (5-Nitrofuran-2-yl)methyl carbamimidothioate hydrobromide?
The molecular weight of (5-Nitrofuran-2-yl)methyl carbamimidothioate hydrobromide is 280.95 g/mol.
Where can I buy (5-Nitrofuran-2-yl)methyl carbamimidothioate hydrobromide?
You can request a quote for (5-Nitrofuran-2-yl)methyl carbamimidothioate hydrobromide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (5-Nitrofuran-2-yl)methyl carbamimidothioate hydrobromide?
Yes, KEHONG BIO provides custom synthesis services for (5-Nitrofuran-2-yl)methyl carbamimidothioate hydrobromide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.