(8E)-2-amino-6-ethyl-8-(3-fluorobenzylidene)-4-(3-fluorophenyl)-5,6,7,8-tetrahydro-4H-pyrano[3,2-c]pyridine-3-carbonitrile
TL;DR: (8E)-2-amino-6-ethyl-8-(3-fluorobenzylidene)-4-(3-fluorophenyl)-5,6,7,8-tetrahydro-4H-pyrano[3,2-c]pyridine-3-carbonitrile (CAS 340691-33-0) is a chemical compound with molecular formula C24H21F2N3O and molecular weight 405.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(8E)-2-amino-6-ethyl-4-(3-fluorophenyl)-8-[(3-fluorophenyl)methylidene]-5,7-dihydro-4H-pyrano[3,2-c]pyridine-3-carbonitrile
Also Known As: (8E)-2-amino-6-ethyl-8-(3-fluorobenzylidene)-4-(3-fluorophenyl)-5,6,7,8-tetrahydro-4H-pyrano[3,2-c]pyridine-3-carbonitrile, (8E)-2-amino-6-ethyl-4-(3-fluorophenyl)-8-[(3-fluorophenyl)methylidene]-5,7-dihydro-4H-pyrano[3,2-c]pyridine-3-carbonitrile, (E)-2-amino-6-ethyl-8-(3-fluorobenzylidene)-4-(3-fluorophenyl)-5,6,7,8-tetrahydro-4H-pyrano[3,2-c]pyridine-3-carbonitrile, 2-amino-6-ethyl-8-(3-fluorobenzylidene)-4-(3-fluorophenyl)-5,6,7,8-tetrahydro-4H-pyrano[3,2-c]pyridine-3-carbonitrile
| Molecular Formula | C24H21F2N3O |
|---|---|
| Molecular Weight | 405.17 g/mol |
| LogP | 4.44568 |
| Topological Polar Surface Area | 62.28 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 405.16528 |
| Heavy Atoms | 30 |
| Complexity | 1127.2661 |
Chemical Identifiers
| CAS Number | 340691-33-0 |
|---|---|
| SMILES | CCN1C/C(=C\C2=CC(=CC=C2)F)/C3=C(C1)C(C(=C(O3)N)C#N)C4=CC(=CC=C4)F |
Product Overview
(8E)-2-amino-6-ethyl-8-(3-fluorobenzylidene)-4-(3-fluorophenyl)-5,6,7,8-tetrahydro-4H-pyrano[3,2-c]pyridine-3-carbonitrile (CAS 340691-33-0), with molecular formula C24H21F2N3O and molecular weight 405.17 g/mol. IUPAC: (8E)-2-amino-6-ethyl-4-(3-fluorophenyl)-8-[(3-fluorophenyl)methylidene]-5,7-dihydro-4H-pyrano[3,2-c]pyridine-3-carbonitrile.
Chemical Property Profile of (8E)-2-amino-6-ethyl-8-(3-fluorobenzylidene)-4-(3-fluorophenyl)-5,6,7,8-tetrahydro-4H-pyrano[3,2-c]pyridine-3-carbonitrile
Property Insights of (8E)-2-amino-6-ethyl-8-(3-fluorobenzylidene)-4-(3-fluorophenyl)-5,6,7,8-tetrahydro-4H-pyrano[3,2-c]pyridine-3-carbonitrile
The XLogP value of 4.44568 indicates that (8E)-2-amino-6-ethyl-8-(3-fluorobenzylidene)-4-(3-fluorophenyl)-5,6,7,8-tetrahydro-4H-pyrano[3,2-c]pyridine-3-carbonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 62.28 Ų falls within the moderate polarity range, balancing permeability and solubility for (8E)-2-amino-6-ethyl-8-(3-fluorobenzylidene)-4-(3-fluorophenyl)-5,6,7,8-tetrahydro-4H-pyrano[3,2-c]pyridine-3-carbonitrile. Following Lipinski's Rule of Five, (8E)-2-amino-6-ethyl-8-(3-fluorobenzylidene)-4-(3-fluorophenyl)-5,6,7,8-tetrahydro-4H-pyrano[3,2-c]pyridine-3-carbonitrile has 1 hydrogen bond donor(s) and 4 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 (8E)-2-amino-6-ethyl-8-(3-fluorobenzylidene)-4-(3-fluorophenyl)-5,6,7,8-tetrahydro-4H-pyrano[3,2-c]pyridine-3-carbonitrile?
The CAS number of (8E)-2-amino-6-ethyl-8-(3-fluorobenzylidene)-4-(3-fluorophenyl)-5,6,7,8-tetrahydro-4H-pyrano[3,2-c]pyridine-3-carbonitrile is 340691-33-0.
What is the molecular formula of (8E)-2-amino-6-ethyl-8-(3-fluorobenzylidene)-4-(3-fluorophenyl)-5,6,7,8-tetrahydro-4H-pyrano[3,2-c]pyridine-3-carbonitrile?
The molecular formula of (8E)-2-amino-6-ethyl-8-(3-fluorobenzylidene)-4-(3-fluorophenyl)-5,6,7,8-tetrahydro-4H-pyrano[3,2-c]pyridine-3-carbonitrile is C24H21F2N3O.
What is the molecular weight of (8E)-2-amino-6-ethyl-8-(3-fluorobenzylidene)-4-(3-fluorophenyl)-5,6,7,8-tetrahydro-4H-pyrano[3,2-c]pyridine-3-carbonitrile?
The molecular weight of (8E)-2-amino-6-ethyl-8-(3-fluorobenzylidene)-4-(3-fluorophenyl)-5,6,7,8-tetrahydro-4H-pyrano[3,2-c]pyridine-3-carbonitrile is 405.17 g/mol.
Where can I buy (8E)-2-amino-6-ethyl-8-(3-fluorobenzylidene)-4-(3-fluorophenyl)-5,6,7,8-tetrahydro-4H-pyrano[3,2-c]pyridine-3-carbonitrile?
You can request a quote for (8E)-2-amino-6-ethyl-8-(3-fluorobenzylidene)-4-(3-fluorophenyl)-5,6,7,8-tetrahydro-4H-pyrano[3,2-c]pyridine-3-carbonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (8E)-2-amino-6-ethyl-8-(3-fluorobenzylidene)-4-(3-fluorophenyl)-5,6,7,8-tetrahydro-4H-pyrano[3,2-c]pyridine-3-carbonitrile?
Yes, KEHONG BIO provides custom synthesis services for (8E)-2-amino-6-ethyl-8-(3-fluorobenzylidene)-4-(3-fluorophenyl)-5,6,7,8-tetrahydro-4H-pyrano[3,2-c]pyridine-3-carbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.