![3-(4-Fluorobenzyl)-5-[(3-methyl-2-thienyl)methylene]-2,4-imidazolidinedione structure](/static/products/499/499114-70-4.png)
3-(4-Fluorobenzyl)-5-[(3-methyl-2-thienyl)methylene]-2,4-imidazolidinedione
TL;DR: 3-(4-Fluorobenzyl)-5-[(3-methyl-2-thienyl)methylene]-2,4-imidazolidinedione (CAS 499114-70-4) is a chemical compound with molecular formula C16H13FN2O2S and molecular weight 316.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5E)-3-[(4-fluorophenyl)methyl]-5-[(3-methylthiophen-2-yl)methylidene]imidazolidine-2,4-dione
Also Known As: AO-081/41228438, 3-(4-fluorobenzyl)-5-[(3-methyl-2-thienyl)methylene]-2,4-imidazolidinedione, (5E)-3-(4-fluorobenzyl)-5-[(3-methylthiophen-2-yl)methylidene]imidazolidine-2,4-dione, (5E)-3-[(4-fluorophenyl)methyl]-5-[(3-methylthiophen-2-yl)methylidene]imidazolidine-2,4-dione
| Molecular Formula | C16H13FN2O2S |
|---|---|
| Molecular Weight | 316.07 g/mol |
| LogP | 3.28852 |
| Topological Polar Surface Area | 49.41 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 316.06818 |
| Heavy Atoms | 22 |
| Complexity | 764.70795 |
Chemical Identifiers
| CAS Number | 499114-70-4 |
|---|---|
| SMILES | CC1=C(SC=C1)/C=C/2\C(=O)N(C(=O)N2)CC3=CC=C(C=C3)F |
Product Overview
3-(4-Fluorobenzyl)-5-[(3-methyl-2-thienyl)methylene]-2,4-imidazolidinedione (CAS 499114-70-4), with molecular formula C16H13FN2O2S and molecular weight 316.07 g/mol. IUPAC: (5E)-3-[(4-fluorophenyl)methyl]-5-[(3-methylthiophen-2-yl)methylidene]imidazolidine-2,4-dione.
Chemical Property Profile of 3-(4-Fluorobenzyl)-5-[(3-methyl-2-thienyl)methylene]-2,4-imidazolidinedione
Property Insights of 3-(4-Fluorobenzyl)-5-[(3-methyl-2-thienyl)methylene]-2,4-imidazolidinedione
The XLogP value of 3.28852 indicates that 3-(4-Fluorobenzyl)-5-[(3-methyl-2-thienyl)methylene]-2,4-imidazolidinedione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.41 Ų, 3-(4-Fluorobenzyl)-5-[(3-methyl-2-thienyl)methylene]-2,4-imidazolidinedione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(4-Fluorobenzyl)-5-[(3-methyl-2-thienyl)methylene]-2,4-imidazolidinedione has 1 hydrogen bond donor(s) and 3 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 3-(4-Fluorobenzyl)-5-[(3-methyl-2-thienyl)methylene]-2,4-imidazolidinedione?
The CAS number of 3-(4-Fluorobenzyl)-5-[(3-methyl-2-thienyl)methylene]-2,4-imidazolidinedione is 499114-70-4.
What is the molecular formula of 3-(4-Fluorobenzyl)-5-[(3-methyl-2-thienyl)methylene]-2,4-imidazolidinedione?
The molecular formula of 3-(4-Fluorobenzyl)-5-[(3-methyl-2-thienyl)methylene]-2,4-imidazolidinedione is C16H13FN2O2S.
What is the molecular weight of 3-(4-Fluorobenzyl)-5-[(3-methyl-2-thienyl)methylene]-2,4-imidazolidinedione?
The molecular weight of 3-(4-Fluorobenzyl)-5-[(3-methyl-2-thienyl)methylene]-2,4-imidazolidinedione is 316.07 g/mol.
Where can I buy 3-(4-Fluorobenzyl)-5-[(3-methyl-2-thienyl)methylene]-2,4-imidazolidinedione?
You can request a quote for 3-(4-Fluorobenzyl)-5-[(3-methyl-2-thienyl)methylene]-2,4-imidazolidinedione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(4-Fluorobenzyl)-5-[(3-methyl-2-thienyl)methylene]-2,4-imidazolidinedione?
Yes, KEHONG BIO provides custom synthesis services for 3-(4-Fluorobenzyl)-5-[(3-methyl-2-thienyl)methylene]-2,4-imidazolidinedione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.