![2-(3-Cyano-4-thiophen-2-yl-6,7-dihydro-5H-[1]pyrindin-2-ylsulfanyl)-propionic acid ethyl ester structure](/static/products/327/327170-17-2.png)
2-(3-Cyano-4-thiophen-2-yl-6,7-dihydro-5H-[1]pyrindin-2-ylsulfanyl)-propionic acid ethyl ester
TL;DR: 2-(3-Cyano-4-thiophen-2-yl-6,7-dihydro-5H-[1]pyrindin-2-ylsulfanyl)-propionic acid ethyl ester (CAS 327170-17-2) is a chemical compound with molecular formula C18H18N2O2S2 and molecular weight 358.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[(3-cyano-4-thiophen-2-yl-6,7-dihydro-5H-cyclopenta[b]pyridin-2-yl)sulfanyl]propanoate
Also Known As: 2-(3-Cyano-4-thiophen-2-yl-6,7-dihydro-5H-[1]pyrindin-2-ylsulfanyl)-propionic acid ethyl ester, ethyl 2-((3-cyano-4-(thiophen-2-yl)-6,7-dihydro-5H-cyclopenta[b]pyridin-2-yl)thio)propanoate, ethyl 2-[(3-cyano-4-thiophen-2-yl-6,7-dihydro-5H-cyclopenta[b]pyridin-2-yl)sulfanyl]propanoate, ethyl 2-{[3-cyano-4-(thiophen-2-yl)-6,7-dihydro-5H-cyclopenta[b]pyridin-2-yl]sulfanyl}propanoate
| Molecular Formula | C18H18N2O2S2 |
|---|---|
| Molecular Weight | 358.08 g/mol |
| LogP | 4.21418 |
| Topological Polar Surface Area | 62.98 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 358.08096 |
| Heavy Atoms | 24 |
| Complexity | 794.33545 |
Chemical Identifiers
| CAS Number | 327170-17-2 |
|---|---|
| SMILES | CCOC(=O)C(C)SC1=NC2=C(CCC2)C(=C1C#N)C3=CC=CS3 |
Product Overview
2-(3-Cyano-4-thiophen-2-yl-6,7-dihydro-5H-[1]pyrindin-2-ylsulfanyl)-propionic acid ethyl ester (CAS 327170-17-2), with molecular formula C18H18N2O2S2 and molecular weight 358.08 g/mol. IUPAC: ethyl 2-[(3-cyano-4-thiophen-2-yl-6,7-dihydro-5H-cyclopenta[b]pyridin-2-yl)sulfanyl]propanoate.
Chemical Property Profile of 2-(3-Cyano-4-thiophen-2-yl-6,7-dihydro-5H-[1]pyrindin-2-ylsulfanyl)-propionic acid ethyl ester
Property Insights of 2-(3-Cyano-4-thiophen-2-yl-6,7-dihydro-5H-[1]pyrindin-2-ylsulfanyl)-propionic acid ethyl ester
The XLogP value of 4.21418 indicates that 2-(3-Cyano-4-thiophen-2-yl-6,7-dihydro-5H-[1]pyrindin-2-ylsulfanyl)-propionic acid ethyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 62.98 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(3-Cyano-4-thiophen-2-yl-6,7-dihydro-5H-[1]pyrindin-2-ylsulfanyl)-propionic acid ethyl ester. Following Lipinski's Rule of Five, 2-(3-Cyano-4-thiophen-2-yl-6,7-dihydro-5H-[1]pyrindin-2-ylsulfanyl)-propionic acid ethyl ester has 0 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-(3-Cyano-4-thiophen-2-yl-6,7-dihydro-5H-[1]pyrindin-2-ylsulfanyl)-propionic acid ethyl ester?
The CAS number of 2-(3-Cyano-4-thiophen-2-yl-6,7-dihydro-5H-[1]pyrindin-2-ylsulfanyl)-propionic acid ethyl ester is 327170-17-2.
What is the molecular formula of 2-(3-Cyano-4-thiophen-2-yl-6,7-dihydro-5H-[1]pyrindin-2-ylsulfanyl)-propionic acid ethyl ester?
The molecular formula of 2-(3-Cyano-4-thiophen-2-yl-6,7-dihydro-5H-[1]pyrindin-2-ylsulfanyl)-propionic acid ethyl ester is C18H18N2O2S2.
What is the molecular weight of 2-(3-Cyano-4-thiophen-2-yl-6,7-dihydro-5H-[1]pyrindin-2-ylsulfanyl)-propionic acid ethyl ester?
The molecular weight of 2-(3-Cyano-4-thiophen-2-yl-6,7-dihydro-5H-[1]pyrindin-2-ylsulfanyl)-propionic acid ethyl ester is 358.08 g/mol.
Where can I buy 2-(3-Cyano-4-thiophen-2-yl-6,7-dihydro-5H-[1]pyrindin-2-ylsulfanyl)-propionic acid ethyl ester?
You can request a quote for 2-(3-Cyano-4-thiophen-2-yl-6,7-dihydro-5H-[1]pyrindin-2-ylsulfanyl)-propionic acid ethyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(3-Cyano-4-thiophen-2-yl-6,7-dihydro-5H-[1]pyrindin-2-ylsulfanyl)-propionic acid ethyl ester?
Yes, KEHONG BIO provides custom synthesis services for 2-(3-Cyano-4-thiophen-2-yl-6,7-dihydro-5H-[1]pyrindin-2-ylsulfanyl)-propionic acid ethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.