2-cyano-N-(2-fluorophenyl)-3-[2-(morpholin-4-yl)-3-[(3-nitrophenyl)methylidene]cyclopent-1-en-1-yl]prop-2-enamide
TL;DR: 2-cyano-N-(2-fluorophenyl)-3-[2-(morpholin-4-yl)-3-[(3-nitrophenyl)methylidene]cyclopent-1-en-1-yl]prop-2-enamide (CAS 1164565-01-8) is a chemical compound with molecular formula C26H23FN4O4 and molecular weight 474.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-2-cyano-N-(2-fluorophenyl)-3-[(3E)-2-morpholin-4-yl-3-[(3-nitrophenyl)methylidene]cyclopenten-1-yl]prop-2-enamide
Also Known As: 2-cyano-N-(2-fluorophenyl)-3-[2-(morpholin-4-yl)-3-[(3-nitrophenyl)methylidene]cyclopent-1-en-1-yl]prop-2-enamide, (E)-2-cyano-N-(2-fluorophenyl)-3-[(3E)-2-morpholin-4-yl-3-[(3-nitrophenyl)methylidene]cyclopenten-1-yl]prop-2-enamide, (E)-2-cyano-N-(2-fluorophenyl)-3-[(3E)-2-(4-morpholinyl)-3-[(3-nitrophenyl)methylidene]-1-cyclopentenyl]-2-propenamide, (E)-2-cyano-N-(2-fluorophenyl)-3-[(3E)-2-morpholino-3-(3-nitrobenzylidene)cyclopenten-1-yl]acrylamide
| Molecular Formula | C26H23FN4O4 |
|---|---|
| Molecular Weight | 474.17 g/mol |
| LogP | 4.58608 |
| Topological Polar Surface Area | 108.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 474.17032 |
| Heavy Atoms | 35 |
| Complexity | 1286.2522 |
Chemical Identifiers
| CAS Number | 1164565-01-8 |
|---|---|
| SMILES | C\1CC(=C(/C1=C/C2=CC(=CC=C2)[N+](=O)[O-])N3CCOCC3)/C=C(\C#N)/C(=O)NC4=CC=CC=C4F |
Product Overview
2-cyano-N-(2-fluorophenyl)-3-[2-(morpholin-4-yl)-3-[(3-nitrophenyl)methylidene]cyclopent-1-en-1-yl]prop-2-enamide (CAS 1164565-01-8), with molecular formula C26H23FN4O4 and molecular weight 474.17 g/mol. IUPAC: (E)-2-cyano-N-(2-fluorophenyl)-3-[(3E)-2-morpholin-4-yl-3-[(3-nitrophenyl)methylidene]cyclopenten-1-yl]prop-2-enamide.
Chemical Property Profile of 2-cyano-N-(2-fluorophenyl)-3-[2-(morpholin-4-yl)-3-[(3-nitrophenyl)methylidene]cyclopent-1-en-1-yl]prop-2-enamide
Property Insights of 2-cyano-N-(2-fluorophenyl)-3-[2-(morpholin-4-yl)-3-[(3-nitrophenyl)methylidene]cyclopent-1-en-1-yl]prop-2-enamide
The XLogP value of 4.58608 indicates that 2-cyano-N-(2-fluorophenyl)-3-[2-(morpholin-4-yl)-3-[(3-nitrophenyl)methylidene]cyclopent-1-en-1-yl]prop-2-enamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 108.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-cyano-N-(2-fluorophenyl)-3-[2-(morpholin-4-yl)-3-[(3-nitrophenyl)methylidene]cyclopent-1-en-1-yl]prop-2-enamide. Following Lipinski's Rule of Five, 2-cyano-N-(2-fluorophenyl)-3-[2-(morpholin-4-yl)-3-[(3-nitrophenyl)methylidene]cyclopent-1-en-1-yl]prop-2-enamide 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 2-cyano-N-(2-fluorophenyl)-3-[2-(morpholin-4-yl)-3-[(3-nitrophenyl)methylidene]cyclopent-1-en-1-yl]prop-2-enamide?
The CAS number of 2-cyano-N-(2-fluorophenyl)-3-[2-(morpholin-4-yl)-3-[(3-nitrophenyl)methylidene]cyclopent-1-en-1-yl]prop-2-enamide is 1164565-01-8.
What is the molecular formula of 2-cyano-N-(2-fluorophenyl)-3-[2-(morpholin-4-yl)-3-[(3-nitrophenyl)methylidene]cyclopent-1-en-1-yl]prop-2-enamide?
The molecular formula of 2-cyano-N-(2-fluorophenyl)-3-[2-(morpholin-4-yl)-3-[(3-nitrophenyl)methylidene]cyclopent-1-en-1-yl]prop-2-enamide is C26H23FN4O4.
What is the molecular weight of 2-cyano-N-(2-fluorophenyl)-3-[2-(morpholin-4-yl)-3-[(3-nitrophenyl)methylidene]cyclopent-1-en-1-yl]prop-2-enamide?
The molecular weight of 2-cyano-N-(2-fluorophenyl)-3-[2-(morpholin-4-yl)-3-[(3-nitrophenyl)methylidene]cyclopent-1-en-1-yl]prop-2-enamide is 474.17 g/mol.
Where can I buy 2-cyano-N-(2-fluorophenyl)-3-[2-(morpholin-4-yl)-3-[(3-nitrophenyl)methylidene]cyclopent-1-en-1-yl]prop-2-enamide?
You can request a quote for 2-cyano-N-(2-fluorophenyl)-3-[2-(morpholin-4-yl)-3-[(3-nitrophenyl)methylidene]cyclopent-1-en-1-yl]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-(2-fluorophenyl)-3-[2-(morpholin-4-yl)-3-[(3-nitrophenyl)methylidene]cyclopent-1-en-1-yl]prop-2-enamide?
Yes, KEHONG BIO provides custom synthesis services for 2-cyano-N-(2-fluorophenyl)-3-[2-(morpholin-4-yl)-3-[(3-nitrophenyl)methylidene]cyclopent-1-en-1-yl]prop-2-enamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.