A3239/0137567
TL;DR: A3239/0137567 (CAS 1022904-18-2) is a chemical compound with molecular formula C27H26FN3O3S and molecular weight 491.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[1-benzyl-3-[2-(4-fluorophenyl)ethyl]-5-oxo-2-sulfanylideneimidazolidin-4-yl]-N-(4-methoxyphenyl)acetamide
Also Known As: A3239/0137567, 2-[1-benzyl-3-[2-(4-fluorophenyl)ethyl]-5-oxo-2-sulfanylideneimidazolidin-4-yl]-N-(4-methoxyphenyl)acetamide, 2-(1-benzyl-3-(4-fluorophenethyl)-5-oxo-2-thioxoimidazolidin-4-yl)-N-(4-methoxyphenyl)acetamide, 2-{1-BENZYL-3-[2-(4-FLUOROPHENYL)ETHYL]-5-OXO-2-SULFANYLIDENEIMIDAZOLIDIN-4-YL}-N-(4-METHOXYPHENYL)ACETAMIDE, 2-{1-benzyl-3-[2-(4-fluorophenyl)ethyl]-5-oxo-2-thioxoimidazolidin-4-yl}-N-(4-methoxyphenyl)acetamide
| Molecular Formula | C27H26FN3O3S |
|---|---|
| Molecular Weight | 491.17 g/mol |
| LogP | 4.4035 |
| Topological Polar Surface Area | 61.88 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 9 |
| Exact Mass | 491.16788 |
| Heavy Atoms | 35 |
| Complexity | 1186.5581 |
Chemical Identifiers
| CAS Number | 1022904-18-2 |
|---|---|
| SMILES | COC1=CC=C(C=C1)NC(=O)CC2C(=O)N(C(=S)N2CCC3=CC=C(C=C3)F)CC4=CC=CC=C4 |
Product Overview
A3239/0137567 (CAS 1022904-18-2), with molecular formula C27H26FN3O3S and molecular weight 491.17 g/mol. IUPAC: 2-[1-benzyl-3-[2-(4-fluorophenyl)ethyl]-5-oxo-2-sulfanylideneimidazolidin-4-yl]-N-(4-methoxyphenyl)acetamide.
Chemical Property Profile of A3239/0137567
Property Insights of A3239/0137567
The XLogP value of 4.4035 indicates that A3239/0137567 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 61.88 Ų falls within the moderate polarity range, balancing permeability and solubility for A3239/0137567. Following Lipinski's Rule of Five, A3239/0137567 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 A3239/0137567?
The CAS number of A3239/0137567 is 1022904-18-2.
What is the molecular formula of A3239/0137567?
The molecular formula of A3239/0137567 is C27H26FN3O3S.
What is the molecular weight of A3239/0137567?
The molecular weight of A3239/0137567 is 491.17 g/mol.
Where can I buy A3239/0137567?
You can request a quote for A3239/0137567 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A3239/0137567?
Yes, KEHONG BIO provides custom synthesis services for A3239/0137567 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.