3-[(6,8-dichloroimidazo[1,2-a]pyridin-2-yl)methylsulfanyl]-1-(trifluoromethyl)-6,7-dihydro-5H-cyclopenta[c]pyridine-4-carbonitrile
TL;DR: 3-[(6,8-dichloroimidazo[1,2-a]pyridin-2-yl)methylsulfanyl]-1-(trifluoromethyl)-6,7-dihydro-5H-cyclopenta[c]pyridine-4-carbonitrile (CAS 828272-59-9) is a chemical compound with molecular formula C18H11Cl2F3N4S and molecular weight 442.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[(6,8-dichloroimidazo[1,2-a]pyridin-2-yl)methylsulfanyl]-1-(trifluoromethyl)-6,7-dihydro-5H-cyclopenta[c]pyridine-4-carbonitrile
Also Known As: 3-[(6,8-dichloroimidazo[1,2-a]pyridin-2-yl)methylsulfanyl]-1-(trifluoromethyl)-6,7-dihydro-5H-cyclopenta[c]pyridine-4-carbonitrile, 3-{[(6,8-DICHLOROIMIDAZO[1,2-A]PYRIDIN-2-YL)METHYL]SULFANYL}-1-(TRIFLUOROMETHYL)-6,7-DIHYDRO-5H-CYCLOPENTA[C]PYRIDIN-4-YL CYANIDE, 3-{[(6,8-dichloroimidazo[1,2-a]pyridin-2-yl)methyl]sulfanyl}-1-(trifluoromethyl)-6,7-dihydro-5H-cyclopenta[c]pyridine-4-carbonitrile
| Molecular Formula | C18H11Cl2F3N4S |
|---|---|
| Molecular Weight | 442.00 g/mol |
| LogP | 5.70758 |
| Topological Polar Surface Area | 53.98 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 442.00336 |
| Heavy Atoms | 28 |
| Complexity | 1134.777 |
Chemical Identifiers
| CAS Number | 828272-59-9 |
|---|---|
| SMILES | C1CC2=C(C1)C(=NC(=C2C#N)SCC3=CN4C=C(C=C(C4=N3)Cl)Cl)C(F)(F)F |
Product Overview
3-[(6,8-dichloroimidazo[1,2-a]pyridin-2-yl)methylsulfanyl]-1-(trifluoromethyl)-6,7-dihydro-5H-cyclopenta[c]pyridine-4-carbonitrile (CAS 828272-59-9), with molecular formula C18H11Cl2F3N4S and molecular weight 442.00 g/mol. IUPAC: 3-[(6,8-dichloroimidazo[1,2-a]pyridin-2-yl)methylsulfanyl]-1-(trifluoromethyl)-6,7-dihydro-5H-cyclopenta[c]pyridine-4-carbonitrile.
Chemical Property Profile of 3-[(6,8-dichloroimidazo[1,2-a]pyridin-2-yl)methylsulfanyl]-1-(trifluoromethyl)-6,7-dihydro-5H-cyclopenta[c]pyridine-4-carbonitrile
Property Insights of 3-[(6,8-dichloroimidazo[1,2-a]pyridin-2-yl)methylsulfanyl]-1-(trifluoromethyl)-6,7-dihydro-5H-cyclopenta[c]pyridine-4-carbonitrile
The XLogP value of 5.70758 indicates that 3-[(6,8-dichloroimidazo[1,2-a]pyridin-2-yl)methylsulfanyl]-1-(trifluoromethyl)-6,7-dihydro-5H-cyclopenta[c]pyridine-4-carbonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 53.98 Ų, 3-[(6,8-dichloroimidazo[1,2-a]pyridin-2-yl)methylsulfanyl]-1-(trifluoromethyl)-6,7-dihydro-5H-cyclopenta[c]pyridine-4-carbonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-[(6,8-dichloroimidazo[1,2-a]pyridin-2-yl)methylsulfanyl]-1-(trifluoromethyl)-6,7-dihydro-5H-cyclopenta[c]pyridine-4-carbonitrile has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3-[(6,8-dichloroimidazo[1,2-a]pyridin-2-yl)methylsulfanyl]-1-(trifluoromethyl)-6,7-dihydro-5H-cyclopenta[c]pyridine-4-carbonitrile?
The CAS number of 3-[(6,8-dichloroimidazo[1,2-a]pyridin-2-yl)methylsulfanyl]-1-(trifluoromethyl)-6,7-dihydro-5H-cyclopenta[c]pyridine-4-carbonitrile is 828272-59-9.
What is the molecular formula of 3-[(6,8-dichloroimidazo[1,2-a]pyridin-2-yl)methylsulfanyl]-1-(trifluoromethyl)-6,7-dihydro-5H-cyclopenta[c]pyridine-4-carbonitrile?
The molecular formula of 3-[(6,8-dichloroimidazo[1,2-a]pyridin-2-yl)methylsulfanyl]-1-(trifluoromethyl)-6,7-dihydro-5H-cyclopenta[c]pyridine-4-carbonitrile is C18H11Cl2F3N4S.
What is the molecular weight of 3-[(6,8-dichloroimidazo[1,2-a]pyridin-2-yl)methylsulfanyl]-1-(trifluoromethyl)-6,7-dihydro-5H-cyclopenta[c]pyridine-4-carbonitrile?
The molecular weight of 3-[(6,8-dichloroimidazo[1,2-a]pyridin-2-yl)methylsulfanyl]-1-(trifluoromethyl)-6,7-dihydro-5H-cyclopenta[c]pyridine-4-carbonitrile is 442.00 g/mol.
Where can I buy 3-[(6,8-dichloroimidazo[1,2-a]pyridin-2-yl)methylsulfanyl]-1-(trifluoromethyl)-6,7-dihydro-5H-cyclopenta[c]pyridine-4-carbonitrile?
You can request a quote for 3-[(6,8-dichloroimidazo[1,2-a]pyridin-2-yl)methylsulfanyl]-1-(trifluoromethyl)-6,7-dihydro-5H-cyclopenta[c]pyridine-4-carbonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-[(6,8-dichloroimidazo[1,2-a]pyridin-2-yl)methylsulfanyl]-1-(trifluoromethyl)-6,7-dihydro-5H-cyclopenta[c]pyridine-4-carbonitrile?
Yes, KEHONG BIO provides custom synthesis services for 3-[(6,8-dichloroimidazo[1,2-a]pyridin-2-yl)methylsulfanyl]-1-(trifluoromethyl)-6,7-dihydro-5H-cyclopenta[c]pyridine-4-carbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.