AJ-292/40763021
TL;DR: AJ-292/40763021 (CAS 487001-67-2) is a chemical compound with molecular formula C20H17F2N3O4S and molecular weight 433.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[5-[2-(4-fluoroanilino)-2-oxoethyl]-3-(4-fluorophenyl)-4-oxo-2-sulfanylideneimidazolidin-1-yl]acetate
Also Known As: AJ-292/40763021, methyl [3-(4-fluorophenyl)-5-{2-[(4-fluorophenyl)amino]-2-oxoethyl}-4-oxo-2-thioxoimidazolidin-1-yl]acetate, {3-(4-Fluoro-phenyl)-5-[(4-fluoro-phenylcarbamoyl)-methyl]-4-oxo-2-thioxo-imidazolidin-1-yl}-acetic acid methyl ester, methyl [5-[2-(4-fluoroanilino)-2-oxoethyl]-3-(4-fluorophenyl)-4-oxo-2-thioxo-1-imidazolidinyl]acetate, methyl 2-(3-(4-fluorophenyl)-5-(2-((4-fluorophenyl)amino)-2-oxoethyl)-4-oxo-2-thioxoimidazolidin-1-yl)acetate
| Molecular Formula | C20H17F2N3O4S |
|---|---|
| Molecular Weight | 433.09 g/mol |
| LogP | 2.4687 |
| Topological Polar Surface Area | 78.95 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 433.0908 |
| Heavy Atoms | 30 |
| Complexity | 982.551 |
Chemical Identifiers
| CAS Number | 487001-67-2 |
|---|---|
| SMILES | COC(=O)CN1C(C(=O)N(C1=S)C2=CC=C(C=C2)F)CC(=O)NC3=CC=C(C=C3)F |
Product Overview
AJ-292/40763021 (CAS 487001-67-2), with molecular formula C20H17F2N3O4S and molecular weight 433.09 g/mol. IUPAC: methyl 2-[5-[2-(4-fluoroanilino)-2-oxoethyl]-3-(4-fluorophenyl)-4-oxo-2-sulfanylideneimidazolidin-1-yl]acetate.
Chemical Property Profile of AJ-292/40763021
Property Insights of AJ-292/40763021
The XLogP value of 2.4687 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AJ-292/40763021. The TPSA of 78.95 Ų falls within the moderate polarity range, balancing permeability and solubility for AJ-292/40763021. Following Lipinski's Rule of Five, AJ-292/40763021 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 AJ-292/40763021?
The CAS number of AJ-292/40763021 is 487001-67-2.
What is the molecular formula of AJ-292/40763021?
The molecular formula of AJ-292/40763021 is C20H17F2N3O4S.
What is the molecular weight of AJ-292/40763021?
The molecular weight of AJ-292/40763021 is 433.09 g/mol.
Where can I buy AJ-292/40763021?
You can request a quote for AJ-292/40763021 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AJ-292/40763021?
Yes, KEHONG BIO provides custom synthesis services for AJ-292/40763021 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.