AF-399/15034012
TL;DR: AF-399/15034012 (CAS 385403-62-3) is a chemical compound with molecular formula C26H25N5O3S and molecular weight 487.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[4-(4-ethoxyphenyl)-5-phenyl-1,2,4-triazol-3-yl]sulfanyl]-N-[(E)-[(E)-3-(furan-2-yl)-2-methylprop-2-enylidene]amino]acetamide
Also Known As: AF-399/15034012, 2-[[4-(4-ethoxyphenyl)-5-phenyl-1,2,4-triazol-3-yl]sulfanyl]-N-[(E)-[(E)-3-(furan-2-yl)-2-methylprop-2-enylidene]amino]acetamide, 2-{[4-(4-ethoxyphenyl)-5-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[3-(2-furyl)-2-methyl-2-propenylidene]acetohydrazide, (E)-2-((4-(4-ethoxyphenyl)-5-phenyl-4H-1,2,4-triazol-3-yl)thio)-N'-((E)-3-(furan-2-yl)-2-methylallylidene)acetohydrazide, 2-{[4-(4-ethoxyphenyl)-5-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(1E,2E)-3-(furan-2-yl)-2-methylprop-2-en-1-ylidene]acetohydrazide
| Molecular Formula | C26H25N5O3S |
|---|---|
| Molecular Weight | 487.17 g/mol |
| LogP | 5.2236 |
| Topological Polar Surface Area | 94.54 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 10 |
| Exact Mass | 487.16782 |
| Heavy Atoms | 35 |
| Complexity | 1296.7828 |
Chemical Identifiers
| CAS Number | 385403-62-3 |
|---|---|
| SMILES | CCOC1=CC=C(C=C1)N2C(=NN=C2SCC(=O)N/N=C/C(=C/C3=CC=CO3)/C)C4=CC=CC=C4 |
Product Overview
AF-399/15034012 (CAS 385403-62-3), with molecular formula C26H25N5O3S and molecular weight 487.17 g/mol. IUPAC: 2-[[4-(4-ethoxyphenyl)-5-phenyl-1,2,4-triazol-3-yl]sulfanyl]-N-[(E)-[(E)-3-(furan-2-yl)-2-methylprop-2-enylidene]amino]acetamide.
Chemical Property Profile of AF-399/15034012
Property Insights of AF-399/15034012
The XLogP value of 5.2236 indicates that AF-399/15034012 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 94.54 Ų falls within the moderate polarity range, balancing permeability and solubility for AF-399/15034012. Following Lipinski's Rule of Five, AF-399/15034012 has 1 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of AF-399/15034012?
The CAS number of AF-399/15034012 is 385403-62-3.
What is the molecular formula of AF-399/15034012?
The molecular formula of AF-399/15034012 is C26H25N5O3S.
What is the molecular weight of AF-399/15034012?
The molecular weight of AF-399/15034012 is 487.17 g/mol.
Where can I buy AF-399/15034012?
You can request a quote for AF-399/15034012 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AF-399/15034012?
Yes, KEHONG BIO provides custom synthesis services for AF-399/15034012 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.