![Methyl 4-[4-(2-chlorophenyl)-1,3-thiazol-2-yl]benzoate structure](/static/products/3383/338396-91-1.webp)
Methyl 4-[4-(2-chlorophenyl)-1,3-thiazol-2-yl]benzoate
TL;DR: Methyl 4-[4-(2-chlorophenyl)-1,3-thiazol-2-yl]benzoate (CAS 338396-91-1) is a chemical compound with molecular formula C17H12ClNO2S and molecular weight 329.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 4-[4-(2-chlorophenyl)-1,3-thiazol-2-yl]benzoate
Also Known As: 2G-306S, methyl 4-[4-(2-chlorophenyl)-1,3-thiazol-2-yl]benzoate, methyl4-[4-(2-chlorophenyl)-1,3-thiazol-2-yl]benzoate, methyl 4-[4-(2-chlorophenyl)-1,3-thiazol-2-yl]benzenecarboxylate
| Molecular Formula | C17H12ClNO2S |
|---|---|
| Molecular Weight | 329.03 g/mol |
| LogP | 4.9171 |
| Topological Polar Surface Area | 39.19 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 329.02774 |
| Heavy Atoms | 22 |
| Complexity | 811.5361 |
Chemical Identifiers
| CAS Number | 338396-91-1 |
|---|---|
| SMILES | COC(=O)C1=CC=C(C=C1)C2=NC(=CS2)C3=CC=CC=C3Cl |
Product Overview
Methyl 4-[4-(2-chlorophenyl)-1,3-thiazol-2-yl]benzoate (CAS 338396-91-1), with molecular formula C17H12ClNO2S and molecular weight 329.03 g/mol. IUPAC: methyl 4-[4-(2-chlorophenyl)-1,3-thiazol-2-yl]benzoate.
Chemical Property Profile of Methyl 4-[4-(2-chlorophenyl)-1,3-thiazol-2-yl]benzoate
Property Insights of Methyl 4-[4-(2-chlorophenyl)-1,3-thiazol-2-yl]benzoate
The XLogP value of 4.9171 indicates that Methyl 4-[4-(2-chlorophenyl)-1,3-thiazol-2-yl]benzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 39.19 Ų, Methyl 4-[4-(2-chlorophenyl)-1,3-thiazol-2-yl]benzoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl 4-[4-(2-chlorophenyl)-1,3-thiazol-2-yl]benzoate has 0 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 Methyl 4-[4-(2-chlorophenyl)-1,3-thiazol-2-yl]benzoate?
The CAS number of Methyl 4-[4-(2-chlorophenyl)-1,3-thiazol-2-yl]benzoate is 338396-91-1.
What is the molecular formula of Methyl 4-[4-(2-chlorophenyl)-1,3-thiazol-2-yl]benzoate?
The molecular formula of Methyl 4-[4-(2-chlorophenyl)-1,3-thiazol-2-yl]benzoate is C17H12ClNO2S.
What is the molecular weight of Methyl 4-[4-(2-chlorophenyl)-1,3-thiazol-2-yl]benzoate?
The molecular weight of Methyl 4-[4-(2-chlorophenyl)-1,3-thiazol-2-yl]benzoate is 329.03 g/mol.
Where can I buy Methyl 4-[4-(2-chlorophenyl)-1,3-thiazol-2-yl]benzoate?
You can request a quote for Methyl 4-[4-(2-chlorophenyl)-1,3-thiazol-2-yl]benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 4-[4-(2-chlorophenyl)-1,3-thiazol-2-yl]benzoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 4-[4-(2-chlorophenyl)-1,3-thiazol-2-yl]benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.