CJ-13610 mesylate
TL;DR: CJ-13610 mesylate (CAS 249296-43-3) is a chemical compound with molecular formula C23H27N3O5S2 and molecular weight 489.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methanesulfonic acid;4-[3-[4-(2-methylimidazol-1-yl)phenyl]sulfanylphenyl]oxane-4-carboxamide
Also Known As: CJ-13610 mesylate, Tox21_300438, CAS-249296-43-3, 2H-Pyran-4-carboxamide, tetrahydro-4-(3-((4-(2-methyl-1H-imidazol-1-yl)phenyl)thio)phenyl)-, methanesulfonate (1:1), 4-(3-(4-(2-Methylimidazol-1-yl)phenylthio))phenyl-3,4,5,6-tetrahydro-2H-pyran-4-carboxamide mesylate
| Molecular Formula | C23H27N3O5S2 |
|---|---|
| Molecular Weight | 489.14 g/mol |
| LogP | 3.36942 |
| Topological Polar Surface Area | 124.51 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 489.13922 |
| Heavy Atoms | 33 |
| Complexity | 1192.8446 |
Chemical Identifiers
| CAS Number | 249296-43-3 |
|---|---|
| SMILES | CC1=NC=CN1C2=CC=C(C=C2)SC3=CC=CC(=C3)C4(CCOCC4)C(=O)N.CS(=O)(=O)O |
Product Overview
CJ-13610 mesylate (CAS 249296-43-3), with molecular formula C23H27N3O5S2 and molecular weight 489.14 g/mol. IUPAC: methanesulfonic acid;4-[3-[4-(2-methylimidazol-1-yl)phenyl]sulfanylphenyl]oxane-4-carboxamide.
Chemical Property Profile of CJ-13610 mesylate
Property Insights of CJ-13610 mesylate
The XLogP value of 3.36942 indicates that CJ-13610 mesylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 124.51 Ų falls within the moderate polarity range, balancing permeability and solubility for CJ-13610 mesylate. Following Lipinski's Rule of Five, CJ-13610 mesylate has 2 hydrogen bond donor(s) and 6 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 CJ-13610 mesylate?
The CAS number of CJ-13610 mesylate is 249296-43-3.
What is the molecular formula of CJ-13610 mesylate?
The molecular formula of CJ-13610 mesylate is C23H27N3O5S2.
What is the molecular weight of CJ-13610 mesylate?
The molecular weight of CJ-13610 mesylate is 489.14 g/mol.
Where can I buy CJ-13610 mesylate?
You can request a quote for CJ-13610 mesylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CJ-13610 mesylate?
Yes, KEHONG BIO provides custom synthesis services for CJ-13610 mesylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.