![(E)-methyl 2-(3-(4-fluorophenyl)-1-(6-methoxybenzo[d]thiazol-2-yl)-5-oxo-2-thioxoimidazolidin-4-ylidene)acetate structure](/static/products/116/1164496-99-4.png)
(E)-methyl 2-(3-(4-fluorophenyl)-1-(6-methoxybenzo[d]thiazol-2-yl)-5-oxo-2-thioxoimidazolidin-4-ylidene)acetate
TL;DR: (E)-methyl 2-(3-(4-fluorophenyl)-1-(6-methoxybenzo[d]thiazol-2-yl)-5-oxo-2-thioxoimidazolidin-4-ylidene)acetate (CAS 1164496-99-4) is a chemical compound with molecular formula C20H14FN3O4S2 and molecular weight 443.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl (2E)-2-[3-(4-fluorophenyl)-1-(6-methoxy-1,3-benzothiazol-2-yl)-5-oxo-2-sulfanylideneimidazolidin-4-ylidene]acetate
Also Known As: (E)-methyl 2-(3-(4-fluorophenyl)-1-(6-methoxybenzo[d]thiazol-2-yl)-5-oxo-2-thioxoimidazolidin-4-ylidene)acetate, [3-(4-Fluoro-phenyl)-1-(6-methoxy-benzothiazol-2-yl)-5-oxo-2-thioxo-imidazolidin-(4E)-ylidene]-acetic acid methyl ester, methyl (2E)-[3-(4-fluorophenyl)-1-(6-methoxy-1,3-benzothiazol-2-yl)-5-oxo-2-thioxoimidazolidin-4-ylidene]ethanoate, methyl (2E)-2-[3-(4-fluorophenyl)-1-(6-methoxy-1,3-benzothiazol-2-yl)-5-oxo-2-sulfanylideneimidazolidin-4-ylidene]acetate
| Molecular Formula | C20H14FN3O4S2 |
|---|---|
| Molecular Weight | 443.04 g/mol |
| LogP | 3.639 |
| Topological Polar Surface Area | 71.97 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 443.041 |
| Heavy Atoms | 30 |
| Complexity | 1206.4869 |
Chemical Identifiers
| CAS Number | 1164496-99-4 |
|---|---|
| SMILES | COC1=CC2=C(C=C1)N=C(S2)N3C(=O)/C(=C\C(=O)OC)/N(C3=S)C4=CC=C(C=C4)F |
Product Overview
(E)-methyl 2-(3-(4-fluorophenyl)-1-(6-methoxybenzo[d]thiazol-2-yl)-5-oxo-2-thioxoimidazolidin-4-ylidene)acetate (CAS 1164496-99-4), with molecular formula C20H14FN3O4S2 and molecular weight 443.04 g/mol. IUPAC: methyl (2E)-2-[3-(4-fluorophenyl)-1-(6-methoxy-1,3-benzothiazol-2-yl)-5-oxo-2-sulfanylideneimidazolidin-4-ylidene]acetate.
Chemical Property Profile of (E)-methyl 2-(3-(4-fluorophenyl)-1-(6-methoxybenzo[d]thiazol-2-yl)-5-oxo-2-thioxoimidazolidin-4-ylidene)acetate
Property Insights of (E)-methyl 2-(3-(4-fluorophenyl)-1-(6-methoxybenzo[d]thiazol-2-yl)-5-oxo-2-thioxoimidazolidin-4-ylidene)acetate
The XLogP value of 3.639 indicates that (E)-methyl 2-(3-(4-fluorophenyl)-1-(6-methoxybenzo[d]thiazol-2-yl)-5-oxo-2-thioxoimidazolidin-4-ylidene)acetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 71.97 Ų falls within the moderate polarity range, balancing permeability and solubility for (E)-methyl 2-(3-(4-fluorophenyl)-1-(6-methoxybenzo[d]thiazol-2-yl)-5-oxo-2-thioxoimidazolidin-4-ylidene)acetate. Following Lipinski's Rule of Five, (E)-methyl 2-(3-(4-fluorophenyl)-1-(6-methoxybenzo[d]thiazol-2-yl)-5-oxo-2-thioxoimidazolidin-4-ylidene)acetate has 0 hydrogen bond donor(s) and 7 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 (E)-methyl 2-(3-(4-fluorophenyl)-1-(6-methoxybenzo[d]thiazol-2-yl)-5-oxo-2-thioxoimidazolidin-4-ylidene)acetate?
The CAS number of (E)-methyl 2-(3-(4-fluorophenyl)-1-(6-methoxybenzo[d]thiazol-2-yl)-5-oxo-2-thioxoimidazolidin-4-ylidene)acetate is 1164496-99-4.
What is the molecular formula of (E)-methyl 2-(3-(4-fluorophenyl)-1-(6-methoxybenzo[d]thiazol-2-yl)-5-oxo-2-thioxoimidazolidin-4-ylidene)acetate?
The molecular formula of (E)-methyl 2-(3-(4-fluorophenyl)-1-(6-methoxybenzo[d]thiazol-2-yl)-5-oxo-2-thioxoimidazolidin-4-ylidene)acetate is C20H14FN3O4S2.
What is the molecular weight of (E)-methyl 2-(3-(4-fluorophenyl)-1-(6-methoxybenzo[d]thiazol-2-yl)-5-oxo-2-thioxoimidazolidin-4-ylidene)acetate?
The molecular weight of (E)-methyl 2-(3-(4-fluorophenyl)-1-(6-methoxybenzo[d]thiazol-2-yl)-5-oxo-2-thioxoimidazolidin-4-ylidene)acetate is 443.04 g/mol.
Where can I buy (E)-methyl 2-(3-(4-fluorophenyl)-1-(6-methoxybenzo[d]thiazol-2-yl)-5-oxo-2-thioxoimidazolidin-4-ylidene)acetate?
You can request a quote for (E)-methyl 2-(3-(4-fluorophenyl)-1-(6-methoxybenzo[d]thiazol-2-yl)-5-oxo-2-thioxoimidazolidin-4-ylidene)acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E)-methyl 2-(3-(4-fluorophenyl)-1-(6-methoxybenzo[d]thiazol-2-yl)-5-oxo-2-thioxoimidazolidin-4-ylidene)acetate?
Yes, KEHONG BIO provides custom synthesis services for (E)-methyl 2-(3-(4-fluorophenyl)-1-(6-methoxybenzo[d]thiazol-2-yl)-5-oxo-2-thioxoimidazolidin-4-ylidene)acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.