(7Z)-2-[(2-ethoxyethyl)sulfanyl]-4-(thiophen-2-yl)-7-[(thiophen-2-yl)methylidene]-5H,6H,7H-cyclopenta[b]pyridine-3-carbonitrile
TL;DR: (7Z)-2-[(2-ethoxyethyl)sulfanyl]-4-(thiophen-2-yl)-7-[(thiophen-2-yl)methylidene]-5H,6H,7H-cyclopenta[b]pyridine-3-carbonitrile (CAS 1164483-99-1) is a chemical compound with molecular formula C22H20N2OS3 and molecular weight 424.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(7E)-2-(2-ethoxyethylsulfanyl)-4-thiophen-2-yl-7-(thiophen-2-ylmethylidene)-5,6-dihydrocyclopenta[b]pyridine-3-carbonitrile
Also Known As: (7Z)-2-[(2-ethoxyethyl)sulfanyl]-4-(thiophen-2-yl)-7-[(thiophen-2-yl)methylidene]-5H,6H,7H-cyclopenta[b]pyridine-3-carbonitrile
| Molecular Formula | C22H20N2OS3 |
|---|---|
| Molecular Weight | 424.07 g/mol |
| LogP | 6.35868 |
| Topological Polar Surface Area | 45.91 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 424.0738 |
| Heavy Atoms | 28 |
| Complexity | 1015.2318 |
Chemical Identifiers
| CAS Number | 1164483-99-1 |
|---|---|
| SMILES | CCOCCSC1=C(C(=C2CC/C(=C\C3=CC=CS3)/C2=N1)C4=CC=CS4)C#N |
Product Overview
(7Z)-2-[(2-ethoxyethyl)sulfanyl]-4-(thiophen-2-yl)-7-[(thiophen-2-yl)methylidene]-5H,6H,7H-cyclopenta[b]pyridine-3-carbonitrile (CAS 1164483-99-1), with molecular formula C22H20N2OS3 and molecular weight 424.07 g/mol. IUPAC: (7E)-2-(2-ethoxyethylsulfanyl)-4-thiophen-2-yl-7-(thiophen-2-ylmethylidene)-5,6-dihydrocyclopenta[b]pyridine-3-carbonitrile.
Chemical Property Profile of (7Z)-2-[(2-ethoxyethyl)sulfanyl]-4-(thiophen-2-yl)-7-[(thiophen-2-yl)methylidene]-5H,6H,7H-cyclopenta[b]pyridine-3-carbonitrile
Property Insights of (7Z)-2-[(2-ethoxyethyl)sulfanyl]-4-(thiophen-2-yl)-7-[(thiophen-2-yl)methylidene]-5H,6H,7H-cyclopenta[b]pyridine-3-carbonitrile
The XLogP value of 6.35868 indicates that (7Z)-2-[(2-ethoxyethyl)sulfanyl]-4-(thiophen-2-yl)-7-[(thiophen-2-yl)methylidene]-5H,6H,7H-cyclopenta[b]pyridine-3-carbonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 45.91 Ų, (7Z)-2-[(2-ethoxyethyl)sulfanyl]-4-(thiophen-2-yl)-7-[(thiophen-2-yl)methylidene]-5H,6H,7H-cyclopenta[b]pyridine-3-carbonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (7Z)-2-[(2-ethoxyethyl)sulfanyl]-4-(thiophen-2-yl)-7-[(thiophen-2-yl)methylidene]-5H,6H,7H-cyclopenta[b]pyridine-3-carbonitrile has 0 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 (7Z)-2-[(2-ethoxyethyl)sulfanyl]-4-(thiophen-2-yl)-7-[(thiophen-2-yl)methylidene]-5H,6H,7H-cyclopenta[b]pyridine-3-carbonitrile?
The CAS number of (7Z)-2-[(2-ethoxyethyl)sulfanyl]-4-(thiophen-2-yl)-7-[(thiophen-2-yl)methylidene]-5H,6H,7H-cyclopenta[b]pyridine-3-carbonitrile is 1164483-99-1.
What is the molecular formula of (7Z)-2-[(2-ethoxyethyl)sulfanyl]-4-(thiophen-2-yl)-7-[(thiophen-2-yl)methylidene]-5H,6H,7H-cyclopenta[b]pyridine-3-carbonitrile?
The molecular formula of (7Z)-2-[(2-ethoxyethyl)sulfanyl]-4-(thiophen-2-yl)-7-[(thiophen-2-yl)methylidene]-5H,6H,7H-cyclopenta[b]pyridine-3-carbonitrile is C22H20N2OS3.
What is the molecular weight of (7Z)-2-[(2-ethoxyethyl)sulfanyl]-4-(thiophen-2-yl)-7-[(thiophen-2-yl)methylidene]-5H,6H,7H-cyclopenta[b]pyridine-3-carbonitrile?
The molecular weight of (7Z)-2-[(2-ethoxyethyl)sulfanyl]-4-(thiophen-2-yl)-7-[(thiophen-2-yl)methylidene]-5H,6H,7H-cyclopenta[b]pyridine-3-carbonitrile is 424.07 g/mol.
Where can I buy (7Z)-2-[(2-ethoxyethyl)sulfanyl]-4-(thiophen-2-yl)-7-[(thiophen-2-yl)methylidene]-5H,6H,7H-cyclopenta[b]pyridine-3-carbonitrile?
You can request a quote for (7Z)-2-[(2-ethoxyethyl)sulfanyl]-4-(thiophen-2-yl)-7-[(thiophen-2-yl)methylidene]-5H,6H,7H-cyclopenta[b]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 (7Z)-2-[(2-ethoxyethyl)sulfanyl]-4-(thiophen-2-yl)-7-[(thiophen-2-yl)methylidene]-5H,6H,7H-cyclopenta[b]pyridine-3-carbonitrile?
Yes, KEHONG BIO provides custom synthesis services for (7Z)-2-[(2-ethoxyethyl)sulfanyl]-4-(thiophen-2-yl)-7-[(thiophen-2-yl)methylidene]-5H,6H,7H-cyclopenta[b]pyridine-3-carbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.