Cox/5-LO-IN-1
TL;DR: Cox/5-LO-IN-1 (CAS 154355-76-7) is a chemical compound with molecular formula C16H15FN2O2S and molecular weight 318.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[4-[5-[(4-fluorophenyl)methyl]thiophen-2-yl]but-3-yn-2-yl]-1-hydroxyurea
Also Known As: Atreleuton, Atreleuton racemic, COX/5-LO-IN-1, 154355-75-6 (racemic), HY-U00347
| Molecular Formula | C16H15FN2O2S |
|---|---|
| Molecular Weight | 318.08 g/mol |
| LogP | 2.9879 |
| Topological Polar Surface Area | 66.56 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 318.08383 |
| Heavy Atoms | 22 |
| Complexity | 715.7373 |
Chemical Identifiers
| CAS Number | 154355-76-7 |
|---|---|
| SMILES | CC(C#CC1=CC=C(S1)CC2=CC=C(C=C2)F)N(C(=O)N)O |
Product Overview
Cox/5-LO-IN-1 (CAS 154355-76-7), with molecular formula C16H15FN2O2S and molecular weight 318.08 g/mol. IUPAC: 1-[4-[5-[(4-fluorophenyl)methyl]thiophen-2-yl]but-3-yn-2-yl]-1-hydroxyurea.
Chemical Property Profile of Cox/5-LO-IN-1
Property Insights of Cox/5-LO-IN-1
The XLogP value of 2.9879 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Cox/5-LO-IN-1. The TPSA of 66.56 Ų falls within the moderate polarity range, balancing permeability and solubility for Cox/5-LO-IN-1. Following Lipinski's Rule of Five, Cox/5-LO-IN-1 has 2 hydrogen bond donor(s) and 3 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 Cox/5-LO-IN-1?
The CAS number of Cox/5-LO-IN-1 is 154355-76-7.
What is the molecular formula of Cox/5-LO-IN-1?
The molecular formula of Cox/5-LO-IN-1 is C16H15FN2O2S.
What is the molecular weight of Cox/5-LO-IN-1?
The molecular weight of Cox/5-LO-IN-1 is 318.08 g/mol.
Where can I buy Cox/5-LO-IN-1?
You can request a quote for Cox/5-LO-IN-1 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Cox/5-LO-IN-1?
Yes, KEHONG BIO provides custom synthesis services for Cox/5-LO-IN-1 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.