F0631-0159
TL;DR: F0631-0159 (CAS 1005050-77-0) is a chemical compound with molecular formula C22H30N4OS and molecular weight 398.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[(3,5-dimethylpiperidin-1-yl)-(4-propan-2-ylphenyl)methyl]-2-methyl-[1,3]thiazolo[3,2-b][1,2,4]triazol-6-ol
Also Known As: F0631-0159, 5-((3,5-dimethylpiperidin-1-yl)(4-isopropylphenyl)methyl)-2-methylthiazolo[3,2-b][1,2,4]triazol-6-ol, 5-[(3,5-dimethylpiperidin-1-yl)-(4-propan-2-ylphenyl)methyl]-2-methyl-[1,3]thiazolo[3,2-b][1,2,4]triazol-6-ol, 5-[(3,5-dimethylpiperidin-1-yl)[4-(propan-2-yl)phenyl]methyl]-2-methyl-[1,2,4]triazolo[3,2-b][1,3]thiazol-6-ol
| Molecular Formula | C22H30N4OS |
|---|---|
| Molecular Weight | 398.21 g/mol |
| LogP | 4.99552 |
| Topological Polar Surface Area | 53.66 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 398.21402 |
| Heavy Atoms | 28 |
| Complexity | 948.9859 |
Chemical Identifiers
| CAS Number | 1005050-77-0 |
|---|---|
| SMILES | CC1CC(CN(C1)C(C2=CC=C(C=C2)C(C)C)C3=C(N4C(=NC(=N4)C)S3)O)C |
Product Overview
F0631-0159 (CAS 1005050-77-0), with molecular formula C22H30N4OS and molecular weight 398.21 g/mol. IUPAC: 5-[(3,5-dimethylpiperidin-1-yl)-(4-propan-2-ylphenyl)methyl]-2-methyl-[1,3]thiazolo[3,2-b][1,2,4]triazol-6-ol.
Chemical Property Profile of F0631-0159
Property Insights of F0631-0159
The XLogP value of 4.99552 indicates that F0631-0159 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 53.66 Ų, F0631-0159 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, F0631-0159 has 1 hydrogen bond donor(s) and 5 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 F0631-0159?
The CAS number of F0631-0159 is 1005050-77-0.
What is the molecular formula of F0631-0159?
The molecular formula of F0631-0159 is C22H30N4OS.
What is the molecular weight of F0631-0159?
The molecular weight of F0631-0159 is 398.21 g/mol.
Where can I buy F0631-0159?
You can request a quote for F0631-0159 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0631-0159?
Yes, KEHONG BIO provides custom synthesis services for F0631-0159 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.