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Methyl 2-(5-cyanoimidazo[2,1-b][1,3]thiazol-6-yl)sulfanylbenzoate
TL;DR: Methyl 2-(5-cyanoimidazo[2,1-b][1,3]thiazol-6-yl)sulfanylbenzoate (CAS 338395-45-2) is a chemical compound with molecular formula C14H9N3O2S2 and molecular weight 315.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-(5-cyanoimidazo[2,1-b][1,3]thiazol-6-yl)sulfanylbenzoate
Also Known As: 2E-147S, methyl 2-(5-cyanoimidazo[2,1-b][1,3]thiazol-6-yl)sulfanylbenzoate, Methyl2-[[5-cyanoimidazo[2,1-b][1,3]thiazol-6-yl]sulfanyl]benzenecarboxylate, methyl 2-({5-cyanoimidazo[2,1-b][1,3]thiazol-6-yl}sulfanyl)benzoate, methyl 2-[(5-cyanoimidazo[2,1-b][1,3]thiazol-6-yl)sulfanyl]benzenecarboxylate
| Molecular Formula | C14H9N3O2S2 |
|---|---|
| Molecular Weight | 315.01 g/mol |
| LogP | 3.20528 |
| Topological Polar Surface Area | 67.39 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 315.0136 |
| Heavy Atoms | 21 |
| Complexity | 860.60175 |
Chemical Identifiers
| CAS Number | 338395-45-2 |
|---|---|
| SMILES | COC(=O)C1=CC=CC=C1SC2=C(N3C=CSC3=N2)C#N |
Product Overview
Methyl 2-(5-cyanoimidazo[2,1-b][1,3]thiazol-6-yl)sulfanylbenzoate (CAS 338395-45-2), with molecular formula C14H9N3O2S2 and molecular weight 315.01 g/mol. IUPAC: methyl 2-(5-cyanoimidazo[2,1-b][1,3]thiazol-6-yl)sulfanylbenzoate.
Chemical Property Profile of Methyl 2-(5-cyanoimidazo[2,1-b][1,3]thiazol-6-yl)sulfanylbenzoate
Property Insights of Methyl 2-(5-cyanoimidazo[2,1-b][1,3]thiazol-6-yl)sulfanylbenzoate
The XLogP value of 3.20528 indicates that Methyl 2-(5-cyanoimidazo[2,1-b][1,3]thiazol-6-yl)sulfanylbenzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 67.39 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 2-(5-cyanoimidazo[2,1-b][1,3]thiazol-6-yl)sulfanylbenzoate. Following Lipinski's Rule of Five, Methyl 2-(5-cyanoimidazo[2,1-b][1,3]thiazol-6-yl)sulfanylbenzoate has 0 hydrogen bond donor(s) and 6 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 Methyl 2-(5-cyanoimidazo[2,1-b][1,3]thiazol-6-yl)sulfanylbenzoate?
The CAS number of Methyl 2-(5-cyanoimidazo[2,1-b][1,3]thiazol-6-yl)sulfanylbenzoate is 338395-45-2.
What is the molecular formula of Methyl 2-(5-cyanoimidazo[2,1-b][1,3]thiazol-6-yl)sulfanylbenzoate?
The molecular formula of Methyl 2-(5-cyanoimidazo[2,1-b][1,3]thiazol-6-yl)sulfanylbenzoate is C14H9N3O2S2.
What is the molecular weight of Methyl 2-(5-cyanoimidazo[2,1-b][1,3]thiazol-6-yl)sulfanylbenzoate?
The molecular weight of Methyl 2-(5-cyanoimidazo[2,1-b][1,3]thiazol-6-yl)sulfanylbenzoate is 315.01 g/mol.
Where can I buy Methyl 2-(5-cyanoimidazo[2,1-b][1,3]thiazol-6-yl)sulfanylbenzoate?
You can request a quote for Methyl 2-(5-cyanoimidazo[2,1-b][1,3]thiazol-6-yl)sulfanylbenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 2-(5-cyanoimidazo[2,1-b][1,3]thiazol-6-yl)sulfanylbenzoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 2-(5-cyanoimidazo[2,1-b][1,3]thiazol-6-yl)sulfanylbenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.