AP-906/41639104
TL;DR: AP-906/41639104 (CAS 518321-19-2) is a chemical compound with molecular formula C25H22N2O6S and molecular weight 478.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 5-[(2,4-dimethylphenyl)sulfonyl-(pyridine-4-carbonyl)amino]-2-methyl-1-benzofuran-3-carboxylate
Also Known As: AP-906/41639104, methyl 5-[[(2,4-dimethylphenyl)sulfonyl](isonicotinoyl)amino]-2-methyl-1-benzofuran-3-carboxylate, METHYL 5-[N-(2,4-DIMETHYLBENZENESULFONYL)PYRIDINE-4-AMIDO]-2-METHYL-1-BENZOFURAN-3-CARBOXYLATE, methyl 5-[(2,4-dimethylphenyl)sulfonyl-(pyridine-4-carbonyl)amino]-2-methyl-1-benzofuran-3-carboxylate, methyl 5-(N-((2,4-dimethylphenyl)sulfonyl)isonicotinamido)-2-methylbenzofuran-3-carboxylate
| Molecular Formula | C25H22N2O6S |
|---|---|
| Molecular Weight | 478.12 g/mol |
| LogP | 4.57536 |
| Topological Polar Surface Area | 106.78 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 478.11984 |
| Heavy Atoms | 34 |
| Complexity | 1524.0544 |
Chemical Identifiers
| CAS Number | 518321-19-2 |
|---|---|
| SMILES | CC1=CC(=C(C=C1)S(=O)(=O)N(C2=CC3=C(C=C2)OC(=C3C(=O)OC)C)C(=O)C4=CC=NC=C4)C |
Product Overview
AP-906/41639104 (CAS 518321-19-2), with molecular formula C25H22N2O6S and molecular weight 478.12 g/mol. IUPAC: methyl 5-[(2,4-dimethylphenyl)sulfonyl-(pyridine-4-carbonyl)amino]-2-methyl-1-benzofuran-3-carboxylate.
Chemical Property Profile of AP-906/41639104
Property Insights of AP-906/41639104
The XLogP value of 4.57536 indicates that AP-906/41639104 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 106.78 Ų falls within the moderate polarity range, balancing permeability and solubility for AP-906/41639104. Following Lipinski's Rule of Five, AP-906/41639104 has 0 hydrogen bond donor(s) and 7 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 AP-906/41639104?
The CAS number of AP-906/41639104 is 518321-19-2.
What is the molecular formula of AP-906/41639104?
The molecular formula of AP-906/41639104 is C25H22N2O6S.
What is the molecular weight of AP-906/41639104?
The molecular weight of AP-906/41639104 is 478.12 g/mol.
Where can I buy AP-906/41639104?
You can request a quote for AP-906/41639104 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AP-906/41639104?
Yes, KEHONG BIO provides custom synthesis services for AP-906/41639104 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.