F0528-0114
TL;DR: F0528-0114 (CAS 476431-72-8) is a chemical compound with molecular formula C21H24N4O3S and molecular weight 412.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-methoxy-N-[[4-(4-methoxyphenyl)-5-propan-2-ylsulfanyl-1,2,4-triazol-3-yl]methyl]benzamide
Also Known As: F0528-0114, N-((5-(isopropylthio)-4-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl)methyl)-4-methoxybenzamide, 4-methoxy-N-[[4-(4-methoxyphenyl)-5-propan-2-ylsulfanyl-1,2,4-triazol-3-yl]methyl]benzamide, 4-methoxy-N-{[4-(4-methoxyphenyl)-5-(propan-2-ylsulfanyl)-4H-1,2,4-triazol-3-yl]methyl}benzamide
| Molecular Formula | C21H24N4O3S |
|---|---|
| Molecular Weight | 412.16 g/mol |
| LogP | 3.715 |
| Topological Polar Surface Area | 78.27 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 412.15692 |
| Heavy Atoms | 29 |
| Complexity | 953.0625 |
Chemical Identifiers
| CAS Number | 476431-72-8 |
|---|---|
| SMILES | CC(C)SC1=NN=C(N1C2=CC=C(C=C2)OC)CNC(=O)C3=CC=C(C=C3)OC |
Product Overview
F0528-0114 (CAS 476431-72-8), with molecular formula C21H24N4O3S and molecular weight 412.16 g/mol. IUPAC: 4-methoxy-N-[[4-(4-methoxyphenyl)-5-propan-2-ylsulfanyl-1,2,4-triazol-3-yl]methyl]benzamide.
Chemical Property Profile of F0528-0114
Property Insights of F0528-0114
The XLogP value of 3.715 indicates that F0528-0114 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 78.27 Ų falls within the moderate polarity range, balancing permeability and solubility for F0528-0114. Following Lipinski's Rule of Five, F0528-0114 has 1 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 F0528-0114?
The CAS number of F0528-0114 is 476431-72-8.
What is the molecular formula of F0528-0114?
The molecular formula of F0528-0114 is C21H24N4O3S.
What is the molecular weight of F0528-0114?
The molecular weight of F0528-0114 is 412.16 g/mol.
Where can I buy F0528-0114?
You can request a quote for F0528-0114 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0528-0114?
Yes, KEHONG BIO provides custom synthesis services for F0528-0114 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.