IFLab1_002875
TL;DR: IFLab1_002875 (CAS 851810-40-7) is a chemical compound with molecular formula C17H19FN4O2S and molecular weight 362.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[(3-fluorophenyl)-(4-hydroxypiperidin-1-yl)methyl]-2-methyl-[1,3]thiazolo[3,2-b][1,2,4]triazol-6-ol
Also Known As: IFLab1_002875, IDI1_009334, F0631-0214, 1-[(3-fluorophenyl)({6-hydroxy-2-methyl-[1,2,4]triazolo[3,2-b][1,3]thiazol-5-yl})methyl]piperidin-4-ol, 5-((3-fluorophenyl)(4-hydroxypiperidin-1-yl)methyl)-2-methylthiazolo[3,2-b][1,2,4]triazol-6-ol
| Molecular Formula | C17H19FN4O2S |
|---|---|
| Molecular Weight | 362.12 g/mol |
| LogP | 2.49002 |
| Topological Polar Surface Area | 73.89 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 362.12128 |
| Heavy Atoms | 25 |
| Complexity | 901.32513 |
Chemical Identifiers
| CAS Number | 851810-40-7 |
|---|---|
| SMILES | CC1=NN2C(=C(SC2=N1)C(C3=CC(=CC=C3)F)N4CCC(CC4)O)O |
Product Overview
IFLab1_002875 (CAS 851810-40-7), with molecular formula C17H19FN4O2S and molecular weight 362.12 g/mol. IUPAC: 5-[(3-fluorophenyl)-(4-hydroxypiperidin-1-yl)methyl]-2-methyl-[1,3]thiazolo[3,2-b][1,2,4]triazol-6-ol.
Chemical Property Profile of IFLab1_002875
Property Insights of IFLab1_002875
The XLogP value of 2.49002 suggests moderate lipophilicity, balancing water solubility and membrane permeability for IFLab1_002875. The TPSA of 73.89 Ų falls within the moderate polarity range, balancing permeability and solubility for IFLab1_002875. Following Lipinski's Rule of Five, IFLab1_002875 has 2 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 IFLab1_002875?
The CAS number of IFLab1_002875 is 851810-40-7.
What is the molecular formula of IFLab1_002875?
The molecular formula of IFLab1_002875 is C17H19FN4O2S.
What is the molecular weight of IFLab1_002875?
The molecular weight of IFLab1_002875 is 362.12 g/mol.
Where can I buy IFLab1_002875?
You can request a quote for IFLab1_002875 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for IFLab1_002875?
Yes, KEHONG BIO provides custom synthesis services for IFLab1_002875 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.