(E)-2-cyano-3-(5-(4-methoxy-2-nitrophenyl)furan-2-yl)prop-2-enethioamide
TL;DR: (E)-2-cyano-3-(5-(4-methoxy-2-nitrophenyl)furan-2-yl)prop-2-enethioamide (CAS 833441-78-4) is a chemical compound with molecular formula C15H11N3O4S and molecular weight 329.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-2-cyano-3-[5-(4-methoxy-2-nitrophenyl)furan-2-yl]prop-2-enethioamide
Also Known As: (E)-2-cyano-3-(5-(4-methoxy-2-nitrophenyl)furan-2-yl)prop-2-enethioamide, (E)-2-cyano-3-[5-(4-methoxy-2-nitrophenyl)furan-2-yl]prop-2-enethioamide, 2-cyano-3-[5-(4-methoxy-2-nitrophenyl)-2-furyl]-2-propenethioamide, (2E)-2-(aminothioxomethyl)-3-[5-(4-methoxy-2-nitrophenyl)(2-furyl)]prop-2-enen itrile, (2E)-2-cyano-3-[5-(4-methoxy-2-nitrophenyl)furan-2-yl]prop-2-enethioamide
| Molecular Formula | C15H11N3O4S |
|---|---|
| Molecular Weight | 329.05 g/mol |
| LogP | 3.05648 |
| Topological Polar Surface Area | 115.32 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 329.04703 |
| Heavy Atoms | 23 |
| Complexity | 848.64716 |
Chemical Identifiers
| CAS Number | 833441-78-4 |
|---|---|
| SMILES | COC1=CC(=C(C=C1)C2=CC=C(O2)/C=C(\C#N)/C(=S)N)[N+](=O)[O-] |
Product Overview
(E)-2-cyano-3-(5-(4-methoxy-2-nitrophenyl)furan-2-yl)prop-2-enethioamide (CAS 833441-78-4), with molecular formula C15H11N3O4S and molecular weight 329.05 g/mol. IUPAC: (E)-2-cyano-3-[5-(4-methoxy-2-nitrophenyl)furan-2-yl]prop-2-enethioamide.
Chemical Property Profile of (E)-2-cyano-3-(5-(4-methoxy-2-nitrophenyl)furan-2-yl)prop-2-enethioamide
Property Insights of (E)-2-cyano-3-(5-(4-methoxy-2-nitrophenyl)furan-2-yl)prop-2-enethioamide
The XLogP value of 3.05648 indicates that (E)-2-cyano-3-(5-(4-methoxy-2-nitrophenyl)furan-2-yl)prop-2-enethioamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 115.32 Ų falls within the moderate polarity range, balancing permeability and solubility for (E)-2-cyano-3-(5-(4-methoxy-2-nitrophenyl)furan-2-yl)prop-2-enethioamide. Following Lipinski's Rule of Five, (E)-2-cyano-3-(5-(4-methoxy-2-nitrophenyl)furan-2-yl)prop-2-enethioamide has 1 hydrogen bond donor(s) and 6 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 (E)-2-cyano-3-(5-(4-methoxy-2-nitrophenyl)furan-2-yl)prop-2-enethioamide?
The CAS number of (E)-2-cyano-3-(5-(4-methoxy-2-nitrophenyl)furan-2-yl)prop-2-enethioamide is 833441-78-4.
What is the molecular formula of (E)-2-cyano-3-(5-(4-methoxy-2-nitrophenyl)furan-2-yl)prop-2-enethioamide?
The molecular formula of (E)-2-cyano-3-(5-(4-methoxy-2-nitrophenyl)furan-2-yl)prop-2-enethioamide is C15H11N3O4S.
What is the molecular weight of (E)-2-cyano-3-(5-(4-methoxy-2-nitrophenyl)furan-2-yl)prop-2-enethioamide?
The molecular weight of (E)-2-cyano-3-(5-(4-methoxy-2-nitrophenyl)furan-2-yl)prop-2-enethioamide is 329.05 g/mol.
Where can I buy (E)-2-cyano-3-(5-(4-methoxy-2-nitrophenyl)furan-2-yl)prop-2-enethioamide?
You can request a quote for (E)-2-cyano-3-(5-(4-methoxy-2-nitrophenyl)furan-2-yl)prop-2-enethioamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E)-2-cyano-3-(5-(4-methoxy-2-nitrophenyl)furan-2-yl)prop-2-enethioamide?
Yes, KEHONG BIO provides custom synthesis services for (E)-2-cyano-3-(5-(4-methoxy-2-nitrophenyl)furan-2-yl)prop-2-enethioamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.