IFLab1_006404
TL;DR: IFLab1_006404 (CAS 868217-01-0) is a chemical compound with molecular formula C19H21N3O3S2 and molecular weight 403.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[4-[[2-(1-phenylethylsulfanyl)-4,5-dihydroimidazol-1-yl]sulfonyl]phenyl]acetamide
Also Known As: IFLab1_006404, F1804-0076, N-(4-((2-((1-phenylethyl)thio)-4,5-dihydro-1H-imidazol-1-yl)sulfonyl)phenyl)acetamide, N-[4-({2-[(1-phenylethyl)sulfanyl]-4,5-dihydro-1H-imidazol-1-yl}sulfonyl)phenyl]acetamide, N-[4-[[2-(1-phenylethylsulfanyl)-4,5-dihydroimidazol-1-yl]sulfonyl]phenyl]acetamide
| Molecular Formula | C19H21N3O3S2 |
|---|---|
| Molecular Weight | 403.10 g/mol |
| LogP | 3.4997 |
| Topological Polar Surface Area | 78.84 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 403.10245 |
| Heavy Atoms | 27 |
| Complexity | 941.925 |
Chemical Identifiers
| CAS Number | 868217-01-0 |
|---|---|
| SMILES | CC(C1=CC=CC=C1)SC2=NCCN2S(=O)(=O)C3=CC=C(C=C3)NC(=O)C |
Product Overview
IFLab1_006404 (CAS 868217-01-0), with molecular formula C19H21N3O3S2 and molecular weight 403.10 g/mol. IUPAC: N-[4-[[2-(1-phenylethylsulfanyl)-4,5-dihydroimidazol-1-yl]sulfonyl]phenyl]acetamide.
Chemical Property Profile of IFLab1_006404
Property Insights of IFLab1_006404
The XLogP value of 3.4997 indicates that IFLab1_006404 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 78.84 Ų falls within the moderate polarity range, balancing permeability and solubility for IFLab1_006404. Following Lipinski's Rule of Five, IFLab1_006404 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 IFLab1_006404?
The CAS number of IFLab1_006404 is 868217-01-0.
What is the molecular formula of IFLab1_006404?
The molecular formula of IFLab1_006404 is C19H21N3O3S2.
What is the molecular weight of IFLab1_006404?
The molecular weight of IFLab1_006404 is 403.10 g/mol.
Where can I buy IFLab1_006404?
You can request a quote for IFLab1_006404 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for IFLab1_006404?
Yes, KEHONG BIO provides custom synthesis services for IFLab1_006404 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.