4T-0239
TL;DR: 4T-0239 (CAS 439108-54-0) is a chemical compound with molecular formula C23H17FN2OS and molecular weight 388.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[2-(2-fluorophenyl)-2-oxoethyl]sulfanyl-1-phenyl-6,7-dihydro-5H-cyclopenta[c]pyridine-4-carbonitrile
Also Known As: 4T-0239, 3-[2-(2-fluorophenyl)-2-oxoethyl]sulfanyl-1-phenyl-6,7-dihydro-5H-cyclopenta[c]pyridine-4-carbonitrile, 3-{[2-(2-fluorophenyl)-2-oxoethyl]sulfanyl}-1-phenyl-6,7-dihydro-5H-cyclopenta[c]pyridine-4-carbonitrile, 3-{[2-(2-fluorophenyl)-2-oxoethyl]sulfanyl}-1-phenyl-5H,6H,7H-cyclopenta[c]pyridine-4-carbonitrile
| Molecular Formula | C23H17FN2OS |
|---|---|
| Molecular Weight | 388.10 g/mol |
| LogP | 5.22308 |
| Topological Polar Surface Area | 53.75 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 388.10455 |
| Heavy Atoms | 28 |
| Complexity | 1089.7467 |
Chemical Identifiers
| CAS Number | 439108-54-0 |
|---|---|
| SMILES | C1CC2=C(C1)C(=NC(=C2C#N)SCC(=O)C3=CC=CC=C3F)C4=CC=CC=C4 |
Product Overview
4T-0239 (CAS 439108-54-0), with molecular formula C23H17FN2OS and molecular weight 388.10 g/mol. IUPAC: 3-[2-(2-fluorophenyl)-2-oxoethyl]sulfanyl-1-phenyl-6,7-dihydro-5H-cyclopenta[c]pyridine-4-carbonitrile.
Chemical Property Profile of 4T-0239
Property Insights of 4T-0239
The XLogP value of 5.22308 indicates that 4T-0239 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 53.75 Ų, 4T-0239 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4T-0239 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 4T-0239?
The CAS number of 4T-0239 is 439108-54-0.
What is the molecular formula of 4T-0239?
The molecular formula of 4T-0239 is C23H17FN2OS.
What is the molecular weight of 4T-0239?
The molecular weight of 4T-0239 is 388.10 g/mol.
Where can I buy 4T-0239?
You can request a quote for 4T-0239 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4T-0239?
Yes, KEHONG BIO provides custom synthesis services for 4T-0239 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.