AN-648/42598079
TL;DR: AN-648/42598079 (CAS 708219-52-7) is a chemical compound with molecular formula C21H21N3O5S and molecular weight 427.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(furan-2-ylmethyl)-2-[[2-[methyl(methylsulfonyl)amino]benzoyl]amino]benzamide
Also Known As: AN-648/42598079, N-(furan-2-ylmethyl)-2-[[2-[methyl(methylsulfonyl)amino]benzoyl]amino]benzamide, N-(2-{[(2-furylmethyl)amino]carbonyl}phenyl)-2-[methyl(methylsulfonyl)amino]benzamide, N-(2-furfuryl)-2-[[2-[mesyl(methyl)amino]benzoyl]amino]benzamide, N-(2-furanylmethyl)-2-[[[2-[methyl(methylsulfonyl)amino]phenyl]-oxomethyl]amino]benzamide
| Molecular Formula | C21H21N3O5S |
|---|---|
| Molecular Weight | 427.12 g/mol |
| LogP | 2.8577 |
| Topological Polar Surface Area | 108.72 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 427.12018 |
| Heavy Atoms | 30 |
| Complexity | 1156.8997 |
Chemical Identifiers
| CAS Number | 708219-52-7 |
|---|---|
| SMILES | CN(C1=CC=CC=C1C(=O)NC2=CC=CC=C2C(=O)NCC3=CC=CO3)S(=O)(=O)C |
Product Overview
AN-648/42598079 (CAS 708219-52-7), with molecular formula C21H21N3O5S and molecular weight 427.12 g/mol. IUPAC: N-(furan-2-ylmethyl)-2-[[2-[methyl(methylsulfonyl)amino]benzoyl]amino]benzamide.
Chemical Property Profile of AN-648/42598079
Property Insights of AN-648/42598079
The XLogP value of 2.8577 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AN-648/42598079. The TPSA of 108.72 Ų falls within the moderate polarity range, balancing permeability and solubility for AN-648/42598079. Following Lipinski's Rule of Five, AN-648/42598079 has 2 hydrogen bond donor(s) and 5 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 AN-648/42598079?
The CAS number of AN-648/42598079 is 708219-52-7.
What is the molecular formula of AN-648/42598079?
The molecular formula of AN-648/42598079 is C21H21N3O5S.
What is the molecular weight of AN-648/42598079?
The molecular weight of AN-648/42598079 is 427.12 g/mol.
Where can I buy AN-648/42598079?
You can request a quote for AN-648/42598079 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AN-648/42598079?
Yes, KEHONG BIO provides custom synthesis services for AN-648/42598079 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.