A3239/0137566
TL;DR: A3239/0137566 (CAS 1009236-47-8) is a chemical compound with molecular formula C21H22FN3O3S and molecular weight 415.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[3-[2-(4-fluorophenyl)ethyl]-1-methyl-5-oxo-2-sulfanylideneimidazolidin-4-yl]-N-(4-methoxyphenyl)acetamide
Also Known As: A3239/0137566, 2-[3-[2-(4-fluorophenyl)ethyl]-1-methyl-5-oxo-2-sulfanylideneimidazolidin-4-yl]-N-(4-methoxyphenyl)acetamide, 2-{3-[2-(4-Fluoro-phenyl)-ethyl]-1-methyl-5-oxo-2-thioxo-imidazolidin-4-yl}-N-(4-methoxy-phenyl)-acetam ide, 2-(3-(4-fluorophenethyl)-1-methyl-5-oxo-2-thioxoimidazolidin-4-yl)-N-(4-methoxyphenyl)acetamide, 2-[3-[2-(4-fluorophenyl)ethyl]-1-methyl-5-oxidanylidene-2-sulfanylidene-imidazolidin-4-yl]-N-(4-methoxyphenyl)ethanamide
| Molecular Formula | C21H22FN3O3S |
|---|---|
| Molecular Weight | 415.14 g/mol |
| LogP | 2.8331 |
| Topological Polar Surface Area | 61.88 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 415.1366 |
| Heavy Atoms | 29 |
| Complexity | 902.3923 |
Chemical Identifiers
| CAS Number | 1009236-47-8 |
|---|---|
| SMILES | CN1C(=O)C(N(C1=S)CCC2=CC=C(C=C2)F)CC(=O)NC3=CC=C(C=C3)OC |
Product Overview
A3239/0137566 (CAS 1009236-47-8), with molecular formula C21H22FN3O3S and molecular weight 415.14 g/mol. IUPAC: 2-[3-[2-(4-fluorophenyl)ethyl]-1-methyl-5-oxo-2-sulfanylideneimidazolidin-4-yl]-N-(4-methoxyphenyl)acetamide.
Chemical Property Profile of A3239/0137566
Property Insights of A3239/0137566
The XLogP value of 2.8331 suggests moderate lipophilicity, balancing water solubility and membrane permeability for A3239/0137566. The TPSA of 61.88 Ų falls within the moderate polarity range, balancing permeability and solubility for A3239/0137566. Following Lipinski's Rule of Five, A3239/0137566 has 1 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 A3239/0137566?
The CAS number of A3239/0137566 is 1009236-47-8.
What is the molecular formula of A3239/0137566?
The molecular formula of A3239/0137566 is C21H22FN3O3S.
What is the molecular weight of A3239/0137566?
The molecular weight of A3239/0137566 is 415.14 g/mol.
Where can I buy A3239/0137566?
You can request a quote for A3239/0137566 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A3239/0137566?
Yes, KEHONG BIO provides custom synthesis services for A3239/0137566 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.