F0631-0044
TL;DR: F0631-0044 (CAS 851809-29-5) is a chemical compound with molecular formula C19H25N5OS and molecular weight 371.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[(4-ethylpiperazin-1-yl)-(4-methylphenyl)methyl]-2-methyl-[1,3]thiazolo[3,2-b][1,2,4]triazol-6-ol
Also Known As: F0631-0044, 5-((4-ethylpiperazin-1-yl)(p-tolyl)methyl)-2-methylthiazolo[3,2-b][1,2,4]triazol-6-ol, 5-[(4-ethylpiperazin-1-yl)(4-methylphenyl)methyl]-2-methyl-[1,2,4]triazolo[3,2-b][1,3]thiazol-6-ol, 5-[(4-ethylpiperazin-1-yl)-(4-methylphenyl)methyl]-2-methyl-[1,3]thiazolo[3,2-b][1,2,4]triazol-6-ol
| Molecular Formula | C19H25N5OS |
|---|---|
| Molecular Weight | 371.18 g/mol |
| LogP | 2.84014 |
| Topological Polar Surface Area | 56.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 371.17798 |
| Heavy Atoms | 26 |
| Complexity | 892.68536 |
Chemical Identifiers
| CAS Number | 851809-29-5 |
|---|---|
| SMILES | CCN1CCN(CC1)C(C2=CC=C(C=C2)C)C3=C(N4C(=NC(=N4)C)S3)O |
Product Overview
F0631-0044 (CAS 851809-29-5), with molecular formula C19H25N5OS and molecular weight 371.18 g/mol. IUPAC: 5-[(4-ethylpiperazin-1-yl)-(4-methylphenyl)methyl]-2-methyl-[1,3]thiazolo[3,2-b][1,2,4]triazol-6-ol.
Chemical Property Profile of F0631-0044
Property Insights of F0631-0044
The XLogP value of 2.84014 suggests moderate lipophilicity, balancing water solubility and membrane permeability for F0631-0044. With a topological polar surface area (TPSA) of 56.9 Ų, F0631-0044 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, F0631-0044 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 F0631-0044?
The CAS number of F0631-0044 is 851809-29-5.
What is the molecular formula of F0631-0044?
The molecular formula of F0631-0044 is C19H25N5OS.
What is the molecular weight of F0631-0044?
The molecular weight of F0631-0044 is 371.18 g/mol.
Where can I buy F0631-0044?
You can request a quote for F0631-0044 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0631-0044?
Yes, KEHONG BIO provides custom synthesis services for F0631-0044 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.