AF-399/15034011
TL;DR: AF-399/15034011 (CAS 385403-60-1) is a chemical compound with molecular formula C27H27N5O4S and molecular weight 517.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(E)-(2,4-dimethoxyphenyl)methylideneamino]-2-[[5-(4-methoxyphenyl)-4-(4-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide
Also Known As: AF-399/15034011, N-[(E)-(2,4-dimethoxyphenyl)methylideneamino]-2-[[5-(4-methoxyphenyl)-4-(4-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide, N'-[(E)-(2,4-dimethoxyphenyl)methylidene]-2-{[5-(4-methoxyphenyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetohydrazide, (E)-N'-(2,4-dimethoxybenzylidene)-2-((5-(4-methoxyphenyl)-4-(p-tolyl)-4H-1,2,4-triazol-3-yl)thio)acetohydrazide, N'-(2,4-dimethoxybenzylidene)-2-{[5-(4-methoxyphenyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetohydrazide
| Molecular Formula | C27H27N5O4S |
|---|---|
| Molecular Weight | 517.18 g/mol |
| LogP | 4.51092 |
| Topological Polar Surface Area | 99.86 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 10 |
| Exact Mass | 517.1784 |
| Heavy Atoms | 37 |
| Complexity | 1385.1843 |
Chemical Identifiers
| CAS Number | 385403-60-1 |
|---|---|
| SMILES | CC1=CC=C(C=C1)N2C(=NN=C2SCC(=O)N/N=C/C3=C(C=C(C=C3)OC)OC)C4=CC=C(C=C4)OC |
Product Overview
AF-399/15034011 (CAS 385403-60-1), with molecular formula C27H27N5O4S and molecular weight 517.18 g/mol. IUPAC: N-[(E)-(2,4-dimethoxyphenyl)methylideneamino]-2-[[5-(4-methoxyphenyl)-4-(4-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide.
Chemical Property Profile of AF-399/15034011
Property Insights of AF-399/15034011
The XLogP value of 4.51092 indicates that AF-399/15034011 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 99.86 Ų falls within the moderate polarity range, balancing permeability and solubility for AF-399/15034011. Following Lipinski's Rule of Five, AF-399/15034011 has 1 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of AF-399/15034011?
The CAS number of AF-399/15034011 is 385403-60-1.
What is the molecular formula of AF-399/15034011?
The molecular formula of AF-399/15034011 is C27H27N5O4S.
What is the molecular weight of AF-399/15034011?
The molecular weight of AF-399/15034011 is 517.18 g/mol.
Where can I buy AF-399/15034011?
You can request a quote for AF-399/15034011 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AF-399/15034011?
Yes, KEHONG BIO provides custom synthesis services for AF-399/15034011 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.