Benfuracarb
TL;DR: Benfuracarb (CAS 82560-54-1) is a chemical compound with molecular formula C20H30N2O5S and molecular weight 410.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 3-[[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxycarbonyl-methylamino]sulfanyl-propan-2-ylamino]propanoate
Also Known As: Benfuracarb, Aminofuracarb, Oncol, Furacon, Oncol 5G
| Molecular Formula | C20H30N2O5S |
|---|---|
| Molecular Weight | 410.19 g/mol |
| LogP | 4.2 |
| Topological Polar Surface Area | 93.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 10 |
| Exact Mass | 410.18753 |
| Heavy Atoms | 28 |
| Complexity | 543.0 |
Chemical Identifiers
| CAS Number | 82560-54-1 |
|---|---|
| SMILES | CCOC(=O)CCN(C(C)C)SN(C)C(=O)OC1=CC=CC2=C1OC(C2)(C)C |
| InChIKey | FYZBOYWSHKHDMT-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 19 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Benfuracarb (CAS 82560-54-1), with molecular formula C20H30N2O5S and molecular weight 410.19 g/mol. IUPAC: ethyl 3-[[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxycarbonyl-methylamino]sulfanyl-propan-2-ylamino]propanoate.
Chemical Property Profile of Benfuracarb
Property Insights of Benfuracarb
The XLogP value of 4.2 indicates that Benfuracarb is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 93.6 Ų falls within the moderate polarity range, balancing permeability and solubility for Benfuracarb. Following Lipinski's Rule of Five, Benfuracarb has 0 hydrogen bond donor(s) and 7 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 Benfuracarb?
The CAS number of Benfuracarb is 82560-54-1.
What is the molecular formula of Benfuracarb?
The molecular formula of Benfuracarb is C20H30N2O5S.
What is the molecular weight of Benfuracarb?
The molecular weight of Benfuracarb is 410.19 g/mol.
Where can I buy Benfuracarb?
You can request a quote for Benfuracarb directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benfuracarb?
Yes, KEHONG BIO provides custom synthesis services for Benfuracarb and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.