F0528-0660
TL;DR: F0528-0660 (CAS 476449-45-3) is a chemical compound with molecular formula C26H31N5O5S and molecular weight 525.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-[[2-[[4-butyl-5-[[(4-methoxybenzoyl)amino]methyl]-1,2,4-triazol-3-yl]sulfanyl]acetyl]amino]benzoate
Also Known As: F0528-0660, ethyl 4-{2-[(4-butyl-5-{[(4-methoxyphenyl)formamido]methyl}-4H-1,2,4-triazol-3-yl)sulfanyl]acetamido}benzoate, ethyl 4-(2-((4-butyl-5-((4-methoxybenzamido)methyl)-4H-1,2,4-triazol-3-yl)thio)acetamido)benzoate, ethyl 4-[[2-[[4-butyl-5-[[(4-methoxybenzoyl)amino]methyl]-1,2,4-triazol-3-yl]sulfanyl]acetyl]amino]benzoate
| Molecular Formula | C26H31N5O5S |
|---|---|
| Molecular Weight | 525.20 g/mol |
| LogP | 3.9243 |
| Topological Polar Surface Area | 124.44 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 13 |
| Exact Mass | 525.2046 |
| Heavy Atoms | 37 |
| Complexity | 1195.0714 |
Chemical Identifiers
| CAS Number | 476449-45-3 |
|---|---|
| SMILES | CCCCN1C(=NN=C1SCC(=O)NC2=CC=C(C=C2)C(=O)OCC)CNC(=O)C3=CC=C(C=C3)OC |
Product Overview
F0528-0660 (CAS 476449-45-3), with molecular formula C26H31N5O5S and molecular weight 525.20 g/mol. IUPAC: ethyl 4-[[2-[[4-butyl-5-[[(4-methoxybenzoyl)amino]methyl]-1,2,4-triazol-3-yl]sulfanyl]acetyl]amino]benzoate.
Chemical Property Profile of F0528-0660
Property Insights of F0528-0660
The XLogP value of 3.9243 indicates that F0528-0660 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 124.44 Ų falls within the moderate polarity range, balancing permeability and solubility for F0528-0660. Following Lipinski's Rule of Five, F0528-0660 has 2 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 F0528-0660?
The CAS number of F0528-0660 is 476449-45-3.
What is the molecular formula of F0528-0660?
The molecular formula of F0528-0660 is C26H31N5O5S.
What is the molecular weight of F0528-0660?
The molecular weight of F0528-0660 is 525.20 g/mol.
Where can I buy F0528-0660?
You can request a quote for F0528-0660 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0528-0660?
Yes, KEHONG BIO provides custom synthesis services for F0528-0660 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.