![2-[(4-Chloro-3-methylphenoxy)methyl]-1,3-benzothiazole structure](/static/products/6389/638995-59-2.webp)
2-[(4-Chloro-3-methylphenoxy)methyl]-1,3-benzothiazole
TL;DR: 2-[(4-Chloro-3-methylphenoxy)methyl]-1,3-benzothiazole (CAS 638995-59-2) is a chemical compound with molecular formula C15H12ClNOS and molecular weight 289.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(4-chloro-3-methylphenoxy)methyl]-1,3-benzothiazole
Also Known As: 2-[(4-chloro-3-methylphenoxy)methyl]-1,3-benzothiazole, 2-(4-CHLORO-3-METHYLPHENOXYMETHYL)-1,3-BENZOTHIAZOLE
| Molecular Formula | C15H12ClNOS |
|---|---|
| Molecular Weight | 289.03 g/mol |
| LogP | 4.83712 |
| Topological Polar Surface Area | 22.12 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 289.0328 |
| Heavy Atoms | 19 |
| Complexity | 689.9924 |
Chemical Identifiers
| CAS Number | 638995-59-2 |
|---|---|
| SMILES | CC1=C(C=CC(=C1)OCC2=NC3=CC=CC=C3S2)Cl |
Product Overview
2-[(4-Chloro-3-methylphenoxy)methyl]-1,3-benzothiazole (CAS 638995-59-2), with molecular formula C15H12ClNOS and molecular weight 289.03 g/mol. IUPAC: 2-[(4-chloro-3-methylphenoxy)methyl]-1,3-benzothiazole.
Chemical Property Profile of 2-[(4-Chloro-3-methylphenoxy)methyl]-1,3-benzothiazole
Property Insights of 2-[(4-Chloro-3-methylphenoxy)methyl]-1,3-benzothiazole
The XLogP value of 4.83712 indicates that 2-[(4-Chloro-3-methylphenoxy)methyl]-1,3-benzothiazole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 22.12 Ų, 2-[(4-Chloro-3-methylphenoxy)methyl]-1,3-benzothiazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-[(4-Chloro-3-methylphenoxy)methyl]-1,3-benzothiazole has 0 hydrogen bond donor(s) and 3 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-[(4-Chloro-3-methylphenoxy)methyl]-1,3-benzothiazole?
The CAS number of 2-[(4-Chloro-3-methylphenoxy)methyl]-1,3-benzothiazole is 638995-59-2.
What is the molecular formula of 2-[(4-Chloro-3-methylphenoxy)methyl]-1,3-benzothiazole?
The molecular formula of 2-[(4-Chloro-3-methylphenoxy)methyl]-1,3-benzothiazole is C15H12ClNOS.
What is the molecular weight of 2-[(4-Chloro-3-methylphenoxy)methyl]-1,3-benzothiazole?
The molecular weight of 2-[(4-Chloro-3-methylphenoxy)methyl]-1,3-benzothiazole is 289.03 g/mol.
Where can I buy 2-[(4-Chloro-3-methylphenoxy)methyl]-1,3-benzothiazole?
You can request a quote for 2-[(4-Chloro-3-methylphenoxy)methyl]-1,3-benzothiazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[(4-Chloro-3-methylphenoxy)methyl]-1,3-benzothiazole?
Yes, KEHONG BIO provides custom synthesis services for 2-[(4-Chloro-3-methylphenoxy)methyl]-1,3-benzothiazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.