F0631-0038
TL;DR: F0631-0038 (CAS 851809-26-2) is a chemical compound with molecular formula C25H28N4OS and molecular weight 432.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[(4-benzylpiperidin-1-yl)-(4-methylphenyl)methyl]-2-methyl-[1,3]thiazolo[3,2-b][1,2,4]triazol-6-ol
Also Known As: F0631-0038, 5-((4-benzylpiperidin-1-yl)(p-tolyl)methyl)-2-methylthiazolo[3,2-b][1,2,4]triazol-6-ol, 5-[(4-benzylpiperidin-1-yl)(4-methylphenyl)methyl]-2-methyl-[1,2,4]triazolo[3,2-b][1,3]thiazol-6-ol, 5-[(4-benzylpiperidin-1-yl)-(4-methylphenyl)methyl]-2-methyl-[1,3]thiazolo[3,2-b][1,2,4]triazol-6-ol
| Molecular Formula | C25H28N4OS |
|---|---|
| Molecular Weight | 432.20 g/mol |
| LogP | 5.15734 |
| Topological Polar Surface Area | 53.66 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 432.1984 |
| Heavy Atoms | 31 |
| Complexity | 1157.6854 |
Chemical Identifiers
| CAS Number | 851809-26-2 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C(C2=C(N3C(=NC(=N3)C)S2)O)N4CCC(CC4)CC5=CC=CC=C5 |
Product Overview
F0631-0038 (CAS 851809-26-2), with molecular formula C25H28N4OS and molecular weight 432.20 g/mol. IUPAC: 5-[(4-benzylpiperidin-1-yl)-(4-methylphenyl)methyl]-2-methyl-[1,3]thiazolo[3,2-b][1,2,4]triazol-6-ol.
Chemical Property Profile of F0631-0038
Property Insights of F0631-0038
The XLogP value of 5.15734 indicates that F0631-0038 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 53.66 Ų, F0631-0038 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, F0631-0038 has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of F0631-0038?
The CAS number of F0631-0038 is 851809-26-2.
What is the molecular formula of F0631-0038?
The molecular formula of F0631-0038 is C25H28N4OS.
What is the molecular weight of F0631-0038?
The molecular weight of F0631-0038 is 432.20 g/mol.
Where can I buy F0631-0038?
You can request a quote for F0631-0038 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0631-0038?
Yes, KEHONG BIO provides custom synthesis services for F0631-0038 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.