AN-329/42548455
TL;DR: AN-329/42548455 (CAS 791791-22-5) is a chemical compound with molecular formula C25H26N4O3S2 and molecular weight 494.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-N-[[4-(4-methylpiperazin-1-yl)sulfonylphenyl]carbamothioyl]-3-naphthalen-1-ylprop-2-enamide
Also Known As: AN-329/42548455, N-{4-[(4-methyl-1-piperazinyl)sulfonyl]phenyl}-N'-[3-(1-naphthyl)acryloyl]thiourea, (E)-N-[[4-(4-methylpiperazin-1-yl)sulfonylphenyl]carbamothioyl]-3-naphthalen-1-ylprop-2-enamide, 2-propenamide, N-[[[4-[(4-methyl-1-piperazinyl)sulfonyl]phenyl]amino]thioxomethyl]-3-(1-naphthalenyl)-, (2E)-, N-[({4-[(4-methyl-1-piperazinyl)sulfonyl]phenyl}amino)carbonothioyl]-3-(1-naphthyl)acrylamide
| Molecular Formula | C25H26N4O3S2 |
|---|---|
| Molecular Weight | 494.14 g/mol |
| LogP | 3.3023 |
| Topological Polar Surface Area | 81.75 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 494.14462 |
| Heavy Atoms | 34 |
| Complexity | 1324.5328 |
Chemical Identifiers
| CAS Number | 791791-22-5 |
|---|---|
| SMILES | CN1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NC(=S)NC(=O)/C=C/C3=CC=CC4=CC=CC=C43 |
Product Overview
AN-329/42548455 (CAS 791791-22-5), with molecular formula C25H26N4O3S2 and molecular weight 494.14 g/mol. IUPAC: (E)-N-[[4-(4-methylpiperazin-1-yl)sulfonylphenyl]carbamothioyl]-3-naphthalen-1-ylprop-2-enamide.
Chemical Property Profile of AN-329/42548455
Property Insights of AN-329/42548455
The XLogP value of 3.3023 indicates that AN-329/42548455 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 81.75 Ų falls within the moderate polarity range, balancing permeability and solubility for AN-329/42548455. Following Lipinski's Rule of Five, AN-329/42548455 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-329/42548455?
The CAS number of AN-329/42548455 is 791791-22-5.
What is the molecular formula of AN-329/42548455?
The molecular formula of AN-329/42548455 is C25H26N4O3S2.
What is the molecular weight of AN-329/42548455?
The molecular weight of AN-329/42548455 is 494.14 g/mol.
Where can I buy AN-329/42548455?
You can request a quote for AN-329/42548455 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AN-329/42548455?
Yes, KEHONG BIO provides custom synthesis services for AN-329/42548455 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.