F0528-1427
TL;DR: F0528-1427 (CAS 477304-02-2) is a chemical compound with molecular formula C26H36N4OS and molecular weight 452.26 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[[5-butylsulfanyl-4-(2-phenylethyl)-1,2,4-triazol-3-yl]methyl]adamantane-1-carboxamide
Also Known As: F0528-1427, (1S,3s)-N-((5-(butylthio)-4-phenethyl-4H-1,2,4-triazol-3-yl)methyl)adamantane-1-carboxamide, N-{[5-(butylsulfanyl)-4-(2-phenylethyl)-4H-1,2,4-triazol-3-yl]methyl}adamantane-1-carboxamide, N-[(5-butylsulfanyl-4-phenethyl-1,2,4-triazol-3-yl)methyl]adamantane-1-carboxamide, N-[[5-butylsulfanyl-4-(2-phenylethyl)-1,2,4-triazol-3-yl]methyl]adamantane-1-carboxamide
| Molecular Formula | C26H36N4OS |
|---|---|
| Molecular Weight | 452.26 g/mol |
| LogP | 5.2456 |
| Topological Polar Surface Area | 59.81 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 10 |
| Exact Mass | 452.261 |
| Heavy Atoms | 32 |
| Complexity | 889.8788 |
Chemical Identifiers
| CAS Number | 477304-02-2 |
|---|---|
| SMILES | CCCCSC1=NN=C(N1CCC2=CC=CC=C2)CNC(=O)C34CC5CC(C3)CC(C5)C4 |
Product Overview
F0528-1427 (CAS 477304-02-2), with molecular formula C26H36N4OS and molecular weight 452.26 g/mol. IUPAC: N-[[5-butylsulfanyl-4-(2-phenylethyl)-1,2,4-triazol-3-yl]methyl]adamantane-1-carboxamide.
Chemical Property Profile of F0528-1427
Property Insights of F0528-1427
The XLogP value of 5.2456 indicates that F0528-1427 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 59.81 Ų, F0528-1427 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, F0528-1427 has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of F0528-1427?
The CAS number of F0528-1427 is 477304-02-2.
What is the molecular formula of F0528-1427?
The molecular formula of F0528-1427 is C26H36N4OS.
What is the molecular weight of F0528-1427?
The molecular weight of F0528-1427 is 452.26 g/mol.
Where can I buy F0528-1427?
You can request a quote for F0528-1427 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0528-1427?
Yes, KEHONG BIO provides custom synthesis services for F0528-1427 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.