![(Z)-propyl 2-((7-benzylidene-3-cyano-4-phenyl-6,7-dihydro-5H-cyclopenta[b]pyridin-2-yl)thio)acetate structure](/static/products/369/369609-72-3.png)
(Z)-propyl 2-((7-benzylidene-3-cyano-4-phenyl-6,7-dihydro-5H-cyclopenta[b]pyridin-2-yl)thio)acetate
TL;DR: (Z)-propyl 2-((7-benzylidene-3-cyano-4-phenyl-6,7-dihydro-5H-cyclopenta[b]pyridin-2-yl)thio)acetate (CAS 369609-72-3) is a chemical compound with molecular formula C27H24N2O2S and molecular weight 440.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
propyl 2-[[(7E)-7-benzylidene-3-cyano-4-phenyl-5,6-dihydrocyclopenta[b]pyridin-2-yl]sulfanyl]acetate
Also Known As: (Z)-propyl 2-((7-benzylidene-3-cyano-4-phenyl-6,7-dihydro-5H-cyclopenta[b]pyridin-2-yl)thio)acetate, propyl {[(7E)-7-benzylidene-3-cyano-4-phenyl-6,7-dihydro-5H-cyclopenta[b]pyridin-2-yl]sulfanyl}acetate, propyl 2-[[(7E)-7-benzylidene-3-cyano-4-phenyl-5,6-dihydrocyclopenta[b]pyridin-2-yl]sulfanyl]acetate
| Molecular Formula | C27H24N2O2S |
|---|---|
| Molecular Weight | 440.16 g/mol |
| LogP | 6.15238 |
| Topological Polar Surface Area | 62.98 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 440.15585 |
| Heavy Atoms | 32 |
| Complexity | 1181.7734 |
Chemical Identifiers
| CAS Number | 369609-72-3 |
|---|---|
| SMILES | CCCOC(=O)CSC1=C(C(=C2CC/C(=C\C3=CC=CC=C3)/C2=N1)C4=CC=CC=C4)C#N |
Product Overview
(Z)-propyl 2-((7-benzylidene-3-cyano-4-phenyl-6,7-dihydro-5H-cyclopenta[b]pyridin-2-yl)thio)acetate (CAS 369609-72-3), with molecular formula C27H24N2O2S and molecular weight 440.16 g/mol. IUPAC: propyl 2-[[(7E)-7-benzylidene-3-cyano-4-phenyl-5,6-dihydrocyclopenta[b]pyridin-2-yl]sulfanyl]acetate.
Chemical Property Profile of (Z)-propyl 2-((7-benzylidene-3-cyano-4-phenyl-6,7-dihydro-5H-cyclopenta[b]pyridin-2-yl)thio)acetate
Property Insights of (Z)-propyl 2-((7-benzylidene-3-cyano-4-phenyl-6,7-dihydro-5H-cyclopenta[b]pyridin-2-yl)thio)acetate
The XLogP value of 6.15238 indicates that (Z)-propyl 2-((7-benzylidene-3-cyano-4-phenyl-6,7-dihydro-5H-cyclopenta[b]pyridin-2-yl)thio)acetate 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 (Z)-propyl 2-((7-benzylidene-3-cyano-4-phenyl-6,7-dihydro-5H-cyclopenta[b]pyridin-2-yl)thio)acetate. Following Lipinski's Rule of Five, (Z)-propyl 2-((7-benzylidene-3-cyano-4-phenyl-6,7-dihydro-5H-cyclopenta[b]pyridin-2-yl)thio)acetate has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (Z)-propyl 2-((7-benzylidene-3-cyano-4-phenyl-6,7-dihydro-5H-cyclopenta[b]pyridin-2-yl)thio)acetate?
The CAS number of (Z)-propyl 2-((7-benzylidene-3-cyano-4-phenyl-6,7-dihydro-5H-cyclopenta[b]pyridin-2-yl)thio)acetate is 369609-72-3.
What is the molecular formula of (Z)-propyl 2-((7-benzylidene-3-cyano-4-phenyl-6,7-dihydro-5H-cyclopenta[b]pyridin-2-yl)thio)acetate?
The molecular formula of (Z)-propyl 2-((7-benzylidene-3-cyano-4-phenyl-6,7-dihydro-5H-cyclopenta[b]pyridin-2-yl)thio)acetate is C27H24N2O2S.
What is the molecular weight of (Z)-propyl 2-((7-benzylidene-3-cyano-4-phenyl-6,7-dihydro-5H-cyclopenta[b]pyridin-2-yl)thio)acetate?
The molecular weight of (Z)-propyl 2-((7-benzylidene-3-cyano-4-phenyl-6,7-dihydro-5H-cyclopenta[b]pyridin-2-yl)thio)acetate is 440.16 g/mol.
Where can I buy (Z)-propyl 2-((7-benzylidene-3-cyano-4-phenyl-6,7-dihydro-5H-cyclopenta[b]pyridin-2-yl)thio)acetate?
You can request a quote for (Z)-propyl 2-((7-benzylidene-3-cyano-4-phenyl-6,7-dihydro-5H-cyclopenta[b]pyridin-2-yl)thio)acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (Z)-propyl 2-((7-benzylidene-3-cyano-4-phenyl-6,7-dihydro-5H-cyclopenta[b]pyridin-2-yl)thio)acetate?
Yes, KEHONG BIO provides custom synthesis services for (Z)-propyl 2-((7-benzylidene-3-cyano-4-phenyl-6,7-dihydro-5H-cyclopenta[b]pyridin-2-yl)thio)acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.