5M-906
TL;DR: 5M-906 (CAS 338962-76-8) is a chemical compound with molecular formula C26H18ClF3N4O3S and molecular weight 558.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(6-acetamido-3-pyridinyl)sulfanyl]-N-[4-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]oxy]phenyl]benzamide
Also Known As: 5M-906, 2-{[6-(acetylamino)-3-pyridinyl]sulfanyl}-N-(4-{[3-chloro-5-(trifluoromethyl)-2-pyridinyl]oxy}phenyl)benzenecarboxamide, 2-(6-acetamidopyridin-3-yl)sulfanyl-N-[4-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]oxyphenyl]benzamide, N-(4-{[3-chloro-5-(trifluoromethyl)pyridin-2-yl]oxy}phenyl)-2-[(6-acetamidopyridin-3-yl)sulfanyl]benzamide
| Molecular Formula | C26H18ClF3N4O3S |
|---|---|
| Molecular Weight | 558.07 g/mol |
| LogP | 7.303 |
| Topological Polar Surface Area | 93.21 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 558.07404 |
| Heavy Atoms | 38 |
| Complexity | 1466.3032 |
Chemical Identifiers
| CAS Number | 338962-76-8 |
|---|---|
| SMILES | CC(=O)NC1=NC=C(C=C1)SC2=CC=CC=C2C(=O)NC3=CC=C(C=C3)OC4=C(C=C(C=N4)C(F)(F)F)Cl |
Product Overview
5M-906 (CAS 338962-76-8), with molecular formula C26H18ClF3N4O3S and molecular weight 558.07 g/mol. IUPAC: 2-[(6-acetamido-3-pyridinyl)sulfanyl]-N-[4-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]oxy]phenyl]benzamide.
Chemical Property Profile of 5M-906
Property Insights of 5M-906
The XLogP value of 7.303 indicates that 5M-906 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 93.21 Ų falls within the moderate polarity range, balancing permeability and solubility for 5M-906. Following Lipinski's Rule of Five, 5M-906 has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 5M-906?
The CAS number of 5M-906 is 338962-76-8.
What is the molecular formula of 5M-906?
The molecular formula of 5M-906 is C26H18ClF3N4O3S.
What is the molecular weight of 5M-906?
The molecular weight of 5M-906 is 558.07 g/mol.
Where can I buy 5M-906?
You can request a quote for 5M-906 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5M-906?
Yes, KEHONG BIO provides custom synthesis services for 5M-906 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.