(2-Chloro-1,3-thiazol-5-yl)methyl 4-iodobenzenecarboxylate
TL;DR: (2-Chloro-1,3-thiazol-5-yl)methyl 4-iodobenzenecarboxylate (CAS 341967-68-8) is a chemical compound with molecular formula C11H7ClINO2S and molecular weight 378.89 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2-chloro-1,3-thiazol-5-yl)methyl 4-iodobenzoate
Also Known As: Bionet1_003299, (2-chloro-1,3-thiazol-5-yl)methyl 4-iodobenzoate, (2-chloro-1,3-thiazol-5-yl)methyl 4-iodobenzenecarboxylate, (2-chlorothiazol-5-yl)methyl 4-iodobenzoate, (2-chloro-1,3-thiazol-5-yl)methyl4-iodobenzoate
| Molecular Formula | C11H7ClINO2S |
|---|---|
| Molecular Weight | 378.89 g/mol |
| LogP | 3.7581 |
| Topological Polar Surface Area | 39.19 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 378.89307 |
| Heavy Atoms | 17 |
| Complexity | 526.52264 |
Chemical Identifiers
| CAS Number | 341967-68-8 |
|---|---|
| SMILES | C1=CC(=CC=C1C(=O)OCC2=CN=C(S2)Cl)I |
Product Overview
(2-Chloro-1,3-thiazol-5-yl)methyl 4-iodobenzenecarboxylate (CAS 341967-68-8), with molecular formula C11H7ClINO2S and molecular weight 378.89 g/mol. IUPAC: (2-chloro-1,3-thiazol-5-yl)methyl 4-iodobenzoate.
Chemical Property Profile of (2-Chloro-1,3-thiazol-5-yl)methyl 4-iodobenzenecarboxylate
Property Insights of (2-Chloro-1,3-thiazol-5-yl)methyl 4-iodobenzenecarboxylate
The XLogP value of 3.7581 indicates that (2-Chloro-1,3-thiazol-5-yl)methyl 4-iodobenzenecarboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 39.19 Ų, (2-Chloro-1,3-thiazol-5-yl)methyl 4-iodobenzenecarboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (2-Chloro-1,3-thiazol-5-yl)methyl 4-iodobenzenecarboxylate 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 (2-Chloro-1,3-thiazol-5-yl)methyl 4-iodobenzenecarboxylate?
The CAS number of (2-Chloro-1,3-thiazol-5-yl)methyl 4-iodobenzenecarboxylate is 341967-68-8.
What is the molecular formula of (2-Chloro-1,3-thiazol-5-yl)methyl 4-iodobenzenecarboxylate?
The molecular formula of (2-Chloro-1,3-thiazol-5-yl)methyl 4-iodobenzenecarboxylate is C11H7ClINO2S.
What is the molecular weight of (2-Chloro-1,3-thiazol-5-yl)methyl 4-iodobenzenecarboxylate?
The molecular weight of (2-Chloro-1,3-thiazol-5-yl)methyl 4-iodobenzenecarboxylate is 378.89 g/mol.
Where can I buy (2-Chloro-1,3-thiazol-5-yl)methyl 4-iodobenzenecarboxylate?
You can request a quote for (2-Chloro-1,3-thiazol-5-yl)methyl 4-iodobenzenecarboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2-Chloro-1,3-thiazol-5-yl)methyl 4-iodobenzenecarboxylate?
Yes, KEHONG BIO provides custom synthesis services for (2-Chloro-1,3-thiazol-5-yl)methyl 4-iodobenzenecarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.