AN-329/42548463
TL;DR: AN-329/42548463 (CAS 791791-27-0) is a chemical compound with molecular formula C23H30N4O3S2 and molecular weight 474.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-tert-butyl-N-[[4-(4-methylpiperazin-1-yl)sulfonylphenyl]carbamothioyl]benzamide
Also Known As: AN-329/42548463, F1724-0573, 4-tert-butyl-N-[[4-(4-methylpiperazin-1-yl)sulfonylphenyl]carbamothioyl]benzamide, 1-(4-tert-butylbenzoyl)-3-{4-[(4-methylpiperazin-1-yl)sulfonyl]phenyl}thiourea, 4-tert-butyl-N-({4-[(4-methylpiperazin-1-yl)sulfonyl]phenyl}carbamothioyl)benzamide
| Molecular Formula | C23H30N4O3S2 |
|---|---|
| Molecular Weight | 474.18 g/mol |
| LogP | 3.047 |
| Topological Polar Surface Area | 81.75 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 474.17593 |
| Heavy Atoms | 32 |
| Complexity | 1067.7197 |
Chemical Identifiers
| CAS Number | 791791-27-0 |
|---|---|
| SMILES | CC(C)(C)C1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=C(C=C2)S(=O)(=O)N3CCN(CC3)C |
Product Overview
AN-329/42548463 (CAS 791791-27-0), with molecular formula C23H30N4O3S2 and molecular weight 474.18 g/mol. IUPAC: 4-tert-butyl-N-[[4-(4-methylpiperazin-1-yl)sulfonylphenyl]carbamothioyl]benzamide.
Chemical Property Profile of AN-329/42548463
Property Insights of AN-329/42548463
The XLogP value of 3.047 indicates that AN-329/42548463 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-329/42548463. Following Lipinski's Rule of Five, AN-329/42548463 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-329/42548463?
The CAS number of AN-329/42548463 is 791791-27-0.
What is the molecular formula of AN-329/42548463?
The molecular formula of AN-329/42548463 is C23H30N4O3S2.
What is the molecular weight of AN-329/42548463?
The molecular weight of AN-329/42548463 is 474.18 g/mol.
Where can I buy AN-329/42548463?
You can request a quote for AN-329/42548463 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AN-329/42548463?
Yes, KEHONG BIO provides custom synthesis services for AN-329/42548463 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.