AN-329/42548458
TL;DR: AN-329/42548458 (CAS 791791-24-7) is a chemical compound with molecular formula C17H19BrN4O4S2 and molecular weight 486.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-bromo-N-[[4-(4-methylpiperazin-1-yl)sulfonylphenyl]carbamothioyl]furan-2-carboxamide
Also Known As: AN-329/42548458, 5-bromo-N-({4-[(4-methylpiperazin-1-yl)sulfonyl]phenyl}carbamothioyl)furan-2-carboxamide, 5-bromo-N-[({4-[(4-methyl-1-piperazinyl)sulfonyl]phenyl}amino)carbonothioyl]-2-furamide, 5-bromo-N-[[4-(4-methylpiperazin-1-yl)sulfonylphenyl]carbamothioyl]furan-2-carboxamide, N-(5-bromo-2-furoyl)-N'-{4-[(4-methyl-1-piperazinyl)sulfonyl]phenyl}thiourea
| Molecular Formula | C17H19BrN4O4S2 |
|---|---|
| Molecular Weight | 486.00 g/mol |
| LogP | 2.105 |
| Topological Polar Surface Area | 94.89 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 486.0031 |
| Heavy Atoms | 28 |
| Complexity | 967.2985 |
Chemical Identifiers
| CAS Number | 791791-24-7 |
|---|---|
| SMILES | CN1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NC(=S)NC(=O)C3=CC=C(O3)Br |
Product Overview
AN-329/42548458 (CAS 791791-24-7), with molecular formula C17H19BrN4O4S2 and molecular weight 486.00 g/mol. IUPAC: 5-bromo-N-[[4-(4-methylpiperazin-1-yl)sulfonylphenyl]carbamothioyl]furan-2-carboxamide.
Chemical Property Profile of AN-329/42548458
Property Insights of AN-329/42548458
The XLogP value of 2.105 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AN-329/42548458. The TPSA of 94.89 Ų falls within the moderate polarity range, balancing permeability and solubility for AN-329/42548458. Following Lipinski's Rule of Five, AN-329/42548458 has 2 hydrogen bond donor(s) and 6 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-329/42548458?
The CAS number of AN-329/42548458 is 791791-24-7.
What is the molecular formula of AN-329/42548458?
The molecular formula of AN-329/42548458 is C17H19BrN4O4S2.
What is the molecular weight of AN-329/42548458?
The molecular weight of AN-329/42548458 is 486.00 g/mol.
Where can I buy AN-329/42548458?
You can request a quote for AN-329/42548458 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AN-329/42548458?
Yes, KEHONG BIO provides custom synthesis services for AN-329/42548458 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.