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Benzo[d]thiazol-2-ylmethyl 2-(4-chlorophenoxy)acetate
TL;DR: Benzo[d]thiazol-2-ylmethyl 2-(4-chlorophenoxy)acetate (CAS 380348-15-2) is a chemical compound with molecular formula C16H12ClNO3S and molecular weight 333.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,3-benzothiazol-2-ylmethyl 2-(4-chlorophenoxy)acetate
Also Known As: (1,3-benzothiazol-2-yl)methyl 2-(4-chlorophenoxy)acetate, benzo[d]thiazol-2-ylmethyl 2-(4-chlorophenoxy)acetate, 1,3-benzothiazol-2-ylmethyl 2-(4-chlorophenoxy)acetate, F0336-0204
| Molecular Formula | C16H12ClNO3S |
|---|---|
| Molecular Weight | 333.02 g/mol |
| LogP | 4.0719 |
| Topological Polar Surface Area | 48.42 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 333.02264 |
| Heavy Atoms | 22 |
| Complexity | 752.44507 |
Chemical Identifiers
| CAS Number | 380348-15-2 |
|---|---|
| SMILES | C1=CC=C2C(=C1)N=C(S2)COC(=O)COC3=CC=C(C=C3)Cl |
Product Overview
Benzo[d]thiazol-2-ylmethyl 2-(4-chlorophenoxy)acetate (CAS 380348-15-2), with molecular formula C16H12ClNO3S and molecular weight 333.02 g/mol. IUPAC: 1,3-benzothiazol-2-ylmethyl 2-(4-chlorophenoxy)acetate.
Chemical Property Profile of Benzo[d]thiazol-2-ylmethyl 2-(4-chlorophenoxy)acetate
Property Insights of Benzo[d]thiazol-2-ylmethyl 2-(4-chlorophenoxy)acetate
The XLogP value of 4.0719 indicates that Benzo[d]thiazol-2-ylmethyl 2-(4-chlorophenoxy)acetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 48.42 Ų, Benzo[d]thiazol-2-ylmethyl 2-(4-chlorophenoxy)acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzo[d]thiazol-2-ylmethyl 2-(4-chlorophenoxy)acetate has 0 hydrogen bond donor(s) and 5 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 Benzo[d]thiazol-2-ylmethyl 2-(4-chlorophenoxy)acetate?
The CAS number of Benzo[d]thiazol-2-ylmethyl 2-(4-chlorophenoxy)acetate is 380348-15-2.
What is the molecular formula of Benzo[d]thiazol-2-ylmethyl 2-(4-chlorophenoxy)acetate?
The molecular formula of Benzo[d]thiazol-2-ylmethyl 2-(4-chlorophenoxy)acetate is C16H12ClNO3S.
What is the molecular weight of Benzo[d]thiazol-2-ylmethyl 2-(4-chlorophenoxy)acetate?
The molecular weight of Benzo[d]thiazol-2-ylmethyl 2-(4-chlorophenoxy)acetate is 333.02 g/mol.
Where can I buy Benzo[d]thiazol-2-ylmethyl 2-(4-chlorophenoxy)acetate?
You can request a quote for Benzo[d]thiazol-2-ylmethyl 2-(4-chlorophenoxy)acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzo[d]thiazol-2-ylmethyl 2-(4-chlorophenoxy)acetate?
Yes, KEHONG BIO provides custom synthesis services for Benzo[d]thiazol-2-ylmethyl 2-(4-chlorophenoxy)acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.