AN-648/40840975
TL;DR: AN-648/40840975 (CAS 432009-86-4) is a chemical compound with molecular formula C27H31N3O3S and molecular weight 477.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-methyl-N-[(4-methylphenyl)methyl]-N-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]benzenesulfonamide
Also Known As: AN-648/40840975, 4-methyl-N-[(4-methylphenyl)methyl]-N-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]benzenesulfonamide, 4-methyl-N-(4-methylbenzyl)-N-[2-oxo-2-(4-phenyl-1-piperazinyl)ethyl]benzenesulfonamide, 4-methyl-N-(4-methylbenzyl)-N-[2-oxo-2-(4-phenylpiperazino)ethyl]-1-benzenesulfonamide, 2-{[(4-methylphenyl)methyl][(4-methylphenyl)sulfonyl]amino}-1-(4-phenylpiperaz inyl)ethan-1-one
| Molecular Formula | C27H31N3O3S |
|---|---|
| Molecular Weight | 477.21 g/mol |
| LogP | 3.84314 |
| Topological Polar Surface Area | 60.93 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 477.20862 |
| Heavy Atoms | 34 |
| Complexity | 1202.2399 |
Chemical Identifiers
| CAS Number | 432009-86-4 |
|---|---|
| SMILES | CC1=CC=C(C=C1)CN(CC(=O)N2CCN(CC2)C3=CC=CC=C3)S(=O)(=O)C4=CC=C(C=C4)C |
Product Overview
AN-648/40840975 (CAS 432009-86-4), with molecular formula C27H31N3O3S and molecular weight 477.21 g/mol. IUPAC: 4-methyl-N-[(4-methylphenyl)methyl]-N-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]benzenesulfonamide.
Chemical Property Profile of AN-648/40840975
Property Insights of AN-648/40840975
The XLogP value of 3.84314 indicates that AN-648/40840975 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 60.93 Ų falls within the moderate polarity range, balancing permeability and solubility for AN-648/40840975. Following Lipinski's Rule of Five, AN-648/40840975 has 0 hydrogen bond donor(s) and 4 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-648/40840975?
The CAS number of AN-648/40840975 is 432009-86-4.
What is the molecular formula of AN-648/40840975?
The molecular formula of AN-648/40840975 is C27H31N3O3S.
What is the molecular weight of AN-648/40840975?
The molecular weight of AN-648/40840975 is 477.21 g/mol.
Where can I buy AN-648/40840975?
You can request a quote for AN-648/40840975 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AN-648/40840975?
Yes, KEHONG BIO provides custom synthesis services for AN-648/40840975 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.