5-bromo-N-(pyrrolidin-1-ylcarbonothioyl)furan-2-carboxamide
TL;DR: 5-bromo-N-(pyrrolidin-1-ylcarbonothioyl)furan-2-carboxamide (CAS 642973-95-3) is a chemical compound with molecular formula C10H11BrN2O2S and molecular weight 301.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-bromo-N-(pyrrolidine-1-carbothioyl)furan-2-carboxamide
Also Known As: 5-bromo-N-(pyrrolidin-1-ylcarbonothioyl)furan-2-carboxamide, 5-bromo-N-(1-pyrrolidinylcarbothioyl)-2-furamide, AN-329/41574557, 5-bromo-N-(pyrrolidine-1-carbothioyl)furan-2-carboxamide
| Molecular Formula | C10H11BrN2O2S |
|---|---|
| Molecular Weight | 301.97 g/mol |
| LogP | 2.1526 |
| Topological Polar Surface Area | 45.48 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 301.97247 |
| Heavy Atoms | 16 |
| Complexity | 412.70645 |
Chemical Identifiers
| CAS Number | 642973-95-3 |
|---|---|
| SMILES | C1CCN(C1)C(=S)NC(=O)C2=CC=C(O2)Br |
Product Overview
5-bromo-N-(pyrrolidin-1-ylcarbonothioyl)furan-2-carboxamide (CAS 642973-95-3), with molecular formula C10H11BrN2O2S and molecular weight 301.97 g/mol. IUPAC: 5-bromo-N-(pyrrolidine-1-carbothioyl)furan-2-carboxamide.
Chemical Property Profile of 5-bromo-N-(pyrrolidin-1-ylcarbonothioyl)furan-2-carboxamide
Property Insights of 5-bromo-N-(pyrrolidin-1-ylcarbonothioyl)furan-2-carboxamide
The XLogP value of 2.1526 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-bromo-N-(pyrrolidin-1-ylcarbonothioyl)furan-2-carboxamide. With a topological polar surface area (TPSA) of 45.48 Ų, 5-bromo-N-(pyrrolidin-1-ylcarbonothioyl)furan-2-carboxamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-bromo-N-(pyrrolidin-1-ylcarbonothioyl)furan-2-carboxamide has 1 hydrogen bond donor(s) and 3 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-bromo-N-(pyrrolidin-1-ylcarbonothioyl)furan-2-carboxamide?
The CAS number of 5-bromo-N-(pyrrolidin-1-ylcarbonothioyl)furan-2-carboxamide is 642973-95-3.
What is the molecular formula of 5-bromo-N-(pyrrolidin-1-ylcarbonothioyl)furan-2-carboxamide?
The molecular formula of 5-bromo-N-(pyrrolidin-1-ylcarbonothioyl)furan-2-carboxamide is C10H11BrN2O2S.
What is the molecular weight of 5-bromo-N-(pyrrolidin-1-ylcarbonothioyl)furan-2-carboxamide?
The molecular weight of 5-bromo-N-(pyrrolidin-1-ylcarbonothioyl)furan-2-carboxamide is 301.97 g/mol.
Where can I buy 5-bromo-N-(pyrrolidin-1-ylcarbonothioyl)furan-2-carboxamide?
You can request a quote for 5-bromo-N-(pyrrolidin-1-ylcarbonothioyl)furan-2-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-bromo-N-(pyrrolidin-1-ylcarbonothioyl)furan-2-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for 5-bromo-N-(pyrrolidin-1-ylcarbonothioyl)furan-2-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.