IFLab1_006506
TL;DR: IFLab1_006506 (CAS 868216-87-9) is a chemical compound with molecular formula C16H14F2N2O2S2 and molecular weight 368.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(4-fluorophenyl)methylsulfanyl]-1-(4-fluorophenyl)sulfonyl-4,5-dihydroimidazole
Also Known As: IFLab1_006506, IFLab2_000292, IDI1_019318, F1804-0060, 1-(4-fluorobenzenesulfonyl)-2-{[(4-fluorophenyl)methyl]sulfanyl}-4,5-dihydro-1H-imidazole
| Molecular Formula | C16H14F2N2O2S2 |
|---|---|
| Molecular Weight | 368.05 g/mol |
| LogP | 3.2585 |
| Topological Polar Surface Area | 49.74 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 368.04648 |
| Heavy Atoms | 24 |
| Complexity | 850.65106 |
Chemical Identifiers
| CAS Number | 868216-87-9 |
|---|---|
| SMILES | C1CN(C(=N1)SCC2=CC=C(C=C2)F)S(=O)(=O)C3=CC=C(C=C3)F |
Product Overview
IFLab1_006506 (CAS 868216-87-9), with molecular formula C16H14F2N2O2S2 and molecular weight 368.05 g/mol. IUPAC: 2-[(4-fluorophenyl)methylsulfanyl]-1-(4-fluorophenyl)sulfonyl-4,5-dihydroimidazole.
Chemical Property Profile of IFLab1_006506
Property Insights of IFLab1_006506
The XLogP value of 3.2585 indicates that IFLab1_006506 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.74 Ų, IFLab1_006506 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, IFLab1_006506 has 0 hydrogen bond donor(s) and 4 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_006506?
The CAS number of IFLab1_006506 is 868216-87-9.
What is the molecular formula of IFLab1_006506?
The molecular formula of IFLab1_006506 is C16H14F2N2O2S2.
What is the molecular weight of IFLab1_006506?
The molecular weight of IFLab1_006506 is 368.05 g/mol.
Where can I buy IFLab1_006506?
You can request a quote for IFLab1_006506 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for IFLab1_006506?
Yes, KEHONG BIO provides custom synthesis services for IFLab1_006506 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.