(5E)-2-amino-5-[[5-(4-chlorophenyl)sulfanylfuran-2-yl]methylidene]-4,6-dimethylcyclopenta[b]pyridine-3,7-dicarbonitrile
TL;DR: (5E)-2-amino-5-[[5-(4-chlorophenyl)sulfanylfuran-2-yl]methylidene]-4,6-dimethylcyclopenta[b]pyridine-3,7-dicarbonitrile (CAS 354129-80-9) is a chemical compound with molecular formula C23H15ClN4OS and molecular weight 430.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5E)-2-amino-5-[[5-(4-chlorophenyl)sulfanylfuran-2-yl]methylidene]-4,6-dimethylcyclopenta[b]pyridine-3,7-dicarbonitrile
Also Known As: (5E)-2-amino-5-[[5-(4-chlorophenyl)sulfanylfuran-2-yl]methylidene]-4,6-dimethylcyclopenta[b]pyridine-3,7-dicarbonitrile, (E)-2-amino-5-((5-((4-chlorophenyl)thio)furan-2-yl)methylene)-4,6-dimethyl-5H-cyclopenta[b]pyridine-3,7-dicarbonitrile
| Molecular Formula | C23H15ClN4OS |
|---|---|
| Molecular Weight | 430.07 g/mol |
| LogP | 6.09278 |
| Topological Polar Surface Area | 99.63 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 430.06552 |
| Heavy Atoms | 30 |
| Complexity | 1320.9585 |
Chemical Identifiers
| CAS Number | 354129-80-9 |
|---|---|
| SMILES | CC\1=C(C2=C(/C1=C/C3=CC=C(O3)SC4=CC=C(C=C4)Cl)C(=C(C(=N2)N)C#N)C)C#N |
Product Overview
(5E)-2-amino-5-[[5-(4-chlorophenyl)sulfanylfuran-2-yl]methylidene]-4,6-dimethylcyclopenta[b]pyridine-3,7-dicarbonitrile (CAS 354129-80-9), with molecular formula C23H15ClN4OS and molecular weight 430.07 g/mol. IUPAC: (5E)-2-amino-5-[[5-(4-chlorophenyl)sulfanylfuran-2-yl]methylidene]-4,6-dimethylcyclopenta[b]pyridine-3,7-dicarbonitrile.
Chemical Property Profile of (5E)-2-amino-5-[[5-(4-chlorophenyl)sulfanylfuran-2-yl]methylidene]-4,6-dimethylcyclopenta[b]pyridine-3,7-dicarbonitrile
Property Insights of (5E)-2-amino-5-[[5-(4-chlorophenyl)sulfanylfuran-2-yl]methylidene]-4,6-dimethylcyclopenta[b]pyridine-3,7-dicarbonitrile
The XLogP value of 6.09278 indicates that (5E)-2-amino-5-[[5-(4-chlorophenyl)sulfanylfuran-2-yl]methylidene]-4,6-dimethylcyclopenta[b]pyridine-3,7-dicarbonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 99.63 Ų falls within the moderate polarity range, balancing permeability and solubility for (5E)-2-amino-5-[[5-(4-chlorophenyl)sulfanylfuran-2-yl]methylidene]-4,6-dimethylcyclopenta[b]pyridine-3,7-dicarbonitrile. Following Lipinski's Rule of Five, (5E)-2-amino-5-[[5-(4-chlorophenyl)sulfanylfuran-2-yl]methylidene]-4,6-dimethylcyclopenta[b]pyridine-3,7-dicarbonitrile has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (5E)-2-amino-5-[[5-(4-chlorophenyl)sulfanylfuran-2-yl]methylidene]-4,6-dimethylcyclopenta[b]pyridine-3,7-dicarbonitrile?
The CAS number of (5E)-2-amino-5-[[5-(4-chlorophenyl)sulfanylfuran-2-yl]methylidene]-4,6-dimethylcyclopenta[b]pyridine-3,7-dicarbonitrile is 354129-80-9.
What is the molecular formula of (5E)-2-amino-5-[[5-(4-chlorophenyl)sulfanylfuran-2-yl]methylidene]-4,6-dimethylcyclopenta[b]pyridine-3,7-dicarbonitrile?
The molecular formula of (5E)-2-amino-5-[[5-(4-chlorophenyl)sulfanylfuran-2-yl]methylidene]-4,6-dimethylcyclopenta[b]pyridine-3,7-dicarbonitrile is C23H15ClN4OS.
What is the molecular weight of (5E)-2-amino-5-[[5-(4-chlorophenyl)sulfanylfuran-2-yl]methylidene]-4,6-dimethylcyclopenta[b]pyridine-3,7-dicarbonitrile?
The molecular weight of (5E)-2-amino-5-[[5-(4-chlorophenyl)sulfanylfuran-2-yl]methylidene]-4,6-dimethylcyclopenta[b]pyridine-3,7-dicarbonitrile is 430.07 g/mol.
Where can I buy (5E)-2-amino-5-[[5-(4-chlorophenyl)sulfanylfuran-2-yl]methylidene]-4,6-dimethylcyclopenta[b]pyridine-3,7-dicarbonitrile?
You can request a quote for (5E)-2-amino-5-[[5-(4-chlorophenyl)sulfanylfuran-2-yl]methylidene]-4,6-dimethylcyclopenta[b]pyridine-3,7-dicarbonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (5E)-2-amino-5-[[5-(4-chlorophenyl)sulfanylfuran-2-yl]methylidene]-4,6-dimethylcyclopenta[b]pyridine-3,7-dicarbonitrile?
Yes, KEHONG BIO provides custom synthesis services for (5E)-2-amino-5-[[5-(4-chlorophenyl)sulfanylfuran-2-yl]methylidene]-4,6-dimethylcyclopenta[b]pyridine-3,7-dicarbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.