F0631-0284
TL;DR: F0631-0284 (CAS 851969-17-0) is a chemical compound with molecular formula C18H22N6O3S and molecular weight 402.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[(4-ethylpiperazin-1-yl)-(4-nitrophenyl)methyl]-2-methyl-[1,3]thiazolo[3,2-b][1,2,4]triazol-6-ol
Also Known As: F0631-0284, 5-((4-ethylpiperazin-1-yl)(4-nitrophenyl)methyl)-2-methylthiazolo[3,2-b][1,2,4]triazol-6-ol, 5-[(4-ethylpiperazin-1-yl)(4-nitrophenyl)methyl]-2-methyl-[1,2,4]triazolo[3,2-b][1,3]thiazol-6-ol, 5-[(4-ethylpiperazin-1-yl)-(4-nitrophenyl)methyl]-2-methyl-[1,3]thiazolo[3,2-b][1,2,4]triazol-6-ol
| Molecular Formula | C18H22N6O3S |
|---|---|
| Molecular Weight | 402.15 g/mol |
| LogP | 2.43992 |
| Topological Polar Surface Area | 100.04 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 5 |
| Exact Mass | 402.1474 |
| Heavy Atoms | 28 |
| Complexity | 990.8374 |
Chemical Identifiers
| CAS Number | 851969-17-0 |
|---|---|
| SMILES | CCN1CCN(CC1)C(C2=CC=C(C=C2)[N+](=O)[O-])C3=C(N4C(=NC(=N4)C)S3)O |
Product Overview
F0631-0284 (CAS 851969-17-0), with molecular formula C18H22N6O3S and molecular weight 402.15 g/mol. IUPAC: 5-[(4-ethylpiperazin-1-yl)-(4-nitrophenyl)methyl]-2-methyl-[1,3]thiazolo[3,2-b][1,2,4]triazol-6-ol.
Chemical Property Profile of F0631-0284
Property Insights of F0631-0284
The XLogP value of 2.43992 suggests moderate lipophilicity, balancing water solubility and membrane permeability for F0631-0284. The TPSA of 100.04 Ų falls within the moderate polarity range, balancing permeability and solubility for F0631-0284. Following Lipinski's Rule of Five, F0631-0284 has 1 hydrogen bond donor(s) and 8 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 F0631-0284?
The CAS number of F0631-0284 is 851969-17-0.
What is the molecular formula of F0631-0284?
The molecular formula of F0631-0284 is C18H22N6O3S.
What is the molecular weight of F0631-0284?
The molecular weight of F0631-0284 is 402.15 g/mol.
Where can I buy F0631-0284?
You can request a quote for F0631-0284 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0631-0284?
Yes, KEHONG BIO provides custom synthesis services for F0631-0284 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.