F0631-0043
TL;DR: F0631-0043 (CAS 162661-16-7) is a chemical compound with molecular formula C18H23N5OS and molecular weight 357.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methyl-5-[(4-methylphenyl)-(4-methylpiperazin-1-yl)methyl]-[1,3]thiazolo[3,2-b][1,2,4]triazol-6-ol
Also Known As: F0631-0043, 2-methyl-5-((4-methylpiperazin-1-yl)(p-tolyl)methyl)thiazolo[3,2-b][1,2,4]triazol-6-ol, 2-methyl-5-[(4-methylphenyl)-(4-methylpiperazin-1-yl)methyl]-[1,3]thiazolo[3,2-b][1,2,4]triazol-6-ol, 2-methyl-5-[(4-methylphenyl)(4-methylpiperazin-1-yl)methyl]-[1,2,4]triazolo[3,2-b][1,3]thiazol-6-ol
| Molecular Formula | C18H23N5OS |
|---|---|
| Molecular Weight | 357.16 g/mol |
| LogP | 2.45004 |
| Topological Polar Surface Area | 56.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 357.16232 |
| Heavy Atoms | 25 |
| Complexity | 876.89374 |
Chemical Identifiers
| CAS Number | 162661-16-7 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C(C2=C(N3C(=NC(=N3)C)S2)O)N4CCN(CC4)C |
Product Overview
F0631-0043 (CAS 162661-16-7), with molecular formula C18H23N5OS and molecular weight 357.16 g/mol. IUPAC: 2-methyl-5-[(4-methylphenyl)-(4-methylpiperazin-1-yl)methyl]-[1,3]thiazolo[3,2-b][1,2,4]triazol-6-ol.
Chemical Property Profile of F0631-0043
Property Insights of F0631-0043
The XLogP value of 2.45004 suggests moderate lipophilicity, balancing water solubility and membrane permeability for F0631-0043. With a topological polar surface area (TPSA) of 56.9 Ų, F0631-0043 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, F0631-0043 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 F0631-0043?
The CAS number of F0631-0043 is 162661-16-7.
What is the molecular formula of F0631-0043?
The molecular formula of F0631-0043 is C18H23N5OS.
What is the molecular weight of F0631-0043?
The molecular weight of F0631-0043 is 357.16 g/mol.
Where can I buy F0631-0043?
You can request a quote for F0631-0043 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0631-0043?
Yes, KEHONG BIO provides custom synthesis services for F0631-0043 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.