![2-cyano-N-[4-(difluoromethylsulfanyl)phenyl]-3-[5-(4-fluorophenyl)-2-furyl]prop-2-enamide structure](/static/products/7442/744211-25-4.webp)
2-cyano-N-[4-(difluoromethylsulfanyl)phenyl]-3-[5-(4-fluorophenyl)-2-furyl]prop-2-enamide
TL;DR: 2-cyano-N-[4-(difluoromethylsulfanyl)phenyl]-3-[5-(4-fluorophenyl)-2-furyl]prop-2-enamide (CAS 744211-25-4) is a chemical compound with molecular formula C21H13F3N2O2S and molecular weight 414.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-2-cyano-N-[4-(difluoromethylsulfanyl)phenyl]-3-[5-(4-fluorophenyl)furan-2-yl]prop-2-enamide
Also Known As: 2-cyano-N-[4-(difluoromethylsulfanyl)phenyl]-3-[5-(4-fluorophenyl)-2-furyl]prop-2-enamide, (E)-2-cyano-N-[4-(difluoromethylsulfanyl)phenyl]-3-[5-(4-fluorophenyl)furan-2-yl]prop-2-enamide, 2-cyano-N-{4-[(difluoromethyl)sulfanyl]phenyl}-3-[5-(4-fluorophenyl)furan-2-yl]prop-2-enamide
| Molecular Formula | C21H13F3N2O2S |
|---|---|
| Molecular Weight | 414.06 g/mol |
| LogP | 5.94608 |
| Topological Polar Surface Area | 66.03 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 414.06497 |
| Heavy Atoms | 29 |
| Complexity | 1068.5557 |
Chemical Identifiers
| CAS Number | 744211-25-4 |
|---|---|
| SMILES | C1=CC(=CC=C1C2=CC=C(O2)/C=C(\C#N)/C(=O)NC3=CC=C(C=C3)SC(F)F)F |
Product Overview
2-cyano-N-[4-(difluoromethylsulfanyl)phenyl]-3-[5-(4-fluorophenyl)-2-furyl]prop-2-enamide (CAS 744211-25-4), with molecular formula C21H13F3N2O2S and molecular weight 414.06 g/mol. IUPAC: (E)-2-cyano-N-[4-(difluoromethylsulfanyl)phenyl]-3-[5-(4-fluorophenyl)furan-2-yl]prop-2-enamide.
Chemical Property Profile of 2-cyano-N-[4-(difluoromethylsulfanyl)phenyl]-3-[5-(4-fluorophenyl)-2-furyl]prop-2-enamide
Property Insights of 2-cyano-N-[4-(difluoromethylsulfanyl)phenyl]-3-[5-(4-fluorophenyl)-2-furyl]prop-2-enamide
The XLogP value of 5.94608 indicates that 2-cyano-N-[4-(difluoromethylsulfanyl)phenyl]-3-[5-(4-fluorophenyl)-2-furyl]prop-2-enamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.03 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-cyano-N-[4-(difluoromethylsulfanyl)phenyl]-3-[5-(4-fluorophenyl)-2-furyl]prop-2-enamide. Following Lipinski's Rule of Five, 2-cyano-N-[4-(difluoromethylsulfanyl)phenyl]-3-[5-(4-fluorophenyl)-2-furyl]prop-2-enamide has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-cyano-N-[4-(difluoromethylsulfanyl)phenyl]-3-[5-(4-fluorophenyl)-2-furyl]prop-2-enamide?
The CAS number of 2-cyano-N-[4-(difluoromethylsulfanyl)phenyl]-3-[5-(4-fluorophenyl)-2-furyl]prop-2-enamide is 744211-25-4.
What is the molecular formula of 2-cyano-N-[4-(difluoromethylsulfanyl)phenyl]-3-[5-(4-fluorophenyl)-2-furyl]prop-2-enamide?
The molecular formula of 2-cyano-N-[4-(difluoromethylsulfanyl)phenyl]-3-[5-(4-fluorophenyl)-2-furyl]prop-2-enamide is C21H13F3N2O2S.
What is the molecular weight of 2-cyano-N-[4-(difluoromethylsulfanyl)phenyl]-3-[5-(4-fluorophenyl)-2-furyl]prop-2-enamide?
The molecular weight of 2-cyano-N-[4-(difluoromethylsulfanyl)phenyl]-3-[5-(4-fluorophenyl)-2-furyl]prop-2-enamide is 414.06 g/mol.
Where can I buy 2-cyano-N-[4-(difluoromethylsulfanyl)phenyl]-3-[5-(4-fluorophenyl)-2-furyl]prop-2-enamide?
You can request a quote for 2-cyano-N-[4-(difluoromethylsulfanyl)phenyl]-3-[5-(4-fluorophenyl)-2-furyl]prop-2-enamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-cyano-N-[4-(difluoromethylsulfanyl)phenyl]-3-[5-(4-fluorophenyl)-2-furyl]prop-2-enamide?
Yes, KEHONG BIO provides custom synthesis services for 2-cyano-N-[4-(difluoromethylsulfanyl)phenyl]-3-[5-(4-fluorophenyl)-2-furyl]prop-2-enamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.