N-(allylcarbamothioyl)-5-bromofuran-2-carboxamide
TL;DR: N-(allylcarbamothioyl)-5-bromofuran-2-carboxamide (CAS 536722-61-9) is a chemical compound with molecular formula C9H9BrN2O2S and molecular weight 287.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-bromo-N-(prop-2-enylcarbamothioyl)furan-2-carboxamide
Also Known As: N-(allylcarbamothioyl)-5-bromofuran-2-carboxamide, 1-(5-BROMOFURAN-2-CARBONYL)-3-(PROP-2-EN-1-YL)THIOUREA, 5-bromo-N-(prop-2-enylcarbamothioyl)furan-2-carboxamide, F1201-0153
| Molecular Formula | C9H9BrN2O2S |
|---|---|
| Molecular Weight | 287.96 g/mol |
| LogP | 1.8324 |
| Topological Polar Surface Area | 54.27 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 287.95682 |
| Heavy Atoms | 15 |
| Complexity | 389.219 |
Chemical Identifiers
| CAS Number | 536722-61-9 |
|---|---|
| SMILES | C=CCNC(=S)NC(=O)C1=CC=C(O1)Br |
Product Overview
N-(allylcarbamothioyl)-5-bromofuran-2-carboxamide (CAS 536722-61-9), with molecular formula C9H9BrN2O2S and molecular weight 287.96 g/mol. IUPAC: 5-bromo-N-(prop-2-enylcarbamothioyl)furan-2-carboxamide.
Chemical Property Profile of N-(allylcarbamothioyl)-5-bromofuran-2-carboxamide
Property Insights of N-(allylcarbamothioyl)-5-bromofuran-2-carboxamide
The XLogP value of 1.8324 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(allylcarbamothioyl)-5-bromofuran-2-carboxamide. With a topological polar surface area (TPSA) of 54.27 Ų, N-(allylcarbamothioyl)-5-bromofuran-2-carboxamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(allylcarbamothioyl)-5-bromofuran-2-carboxamide has 2 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 N-(allylcarbamothioyl)-5-bromofuran-2-carboxamide?
The CAS number of N-(allylcarbamothioyl)-5-bromofuran-2-carboxamide is 536722-61-9.
What is the molecular formula of N-(allylcarbamothioyl)-5-bromofuran-2-carboxamide?
The molecular formula of N-(allylcarbamothioyl)-5-bromofuran-2-carboxamide is C9H9BrN2O2S.
What is the molecular weight of N-(allylcarbamothioyl)-5-bromofuran-2-carboxamide?
The molecular weight of N-(allylcarbamothioyl)-5-bromofuran-2-carboxamide is 287.96 g/mol.
Where can I buy N-(allylcarbamothioyl)-5-bromofuran-2-carboxamide?
You can request a quote for N-(allylcarbamothioyl)-5-bromofuran-2-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(allylcarbamothioyl)-5-bromofuran-2-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for N-(allylcarbamothioyl)-5-bromofuran-2-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.