![N-[5-(1,3-benzothiazol-2-yl)-2-chlorophenyl]-2-(4-bromophenoxy)acetamide structure](/static/products/6451/6451-57-6.webp)
N-[5-(1,3-benzothiazol-2-yl)-2-chlorophenyl]-2-(4-bromophenoxy)acetamide
TL;DR: N-[5-(1,3-benzothiazol-2-yl)-2-chlorophenyl]-2-(4-bromophenoxy)acetamide (CAS 6451-57-6) is a chemical compound with molecular formula C21H14BrClN2O2S and molecular weight 471.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[5-(1,3-benzothiazol-2-yl)-2-chlorophenyl]-2-(4-bromophenoxy)acetamide
Also Known As: 3-(3-methoxyphenoxy)propan-1-amine, N-[5-(1,3-benzothiazol-2-yl)-2-chlorophenyl]-2-(4-bromophenoxy)acetamide, Spiro[2H-1,2,4-benzothiadiazine-3(4H),4'-piperidine]-7-sulfonamide,6-chloro-1'-ethyl-, 1,1-dioxide, hydrochloride (1:1)
| Molecular Formula | C21H14BrClN2O2S |
|---|---|
| Molecular Weight | 471.96 g/mol |
| LogP | 6.3967 |
| Topological Polar Surface Area | 51.22 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 471.96478 |
| Heavy Atoms | 28 |
| Complexity | 1111.8268 |
Chemical Identifiers
| CAS Number | 6451-57-6 |
|---|---|
| SMILES | C1=CC=C2C(=C1)N=C(S2)C3=CC(=C(C=C3)Cl)NC(=O)COC4=CC=C(C=C4)Br |
Product Overview
N-[5-(1,3-benzothiazol-2-yl)-2-chlorophenyl]-2-(4-bromophenoxy)acetamide (CAS 6451-57-6), with molecular formula C21H14BrClN2O2S and molecular weight 471.96 g/mol. IUPAC: N-[5-(1,3-benzothiazol-2-yl)-2-chlorophenyl]-2-(4-bromophenoxy)acetamide.
Chemical Property Profile of N-[5-(1,3-benzothiazol-2-yl)-2-chlorophenyl]-2-(4-bromophenoxy)acetamide
Property Insights of N-[5-(1,3-benzothiazol-2-yl)-2-chlorophenyl]-2-(4-bromophenoxy)acetamide
The XLogP value of 6.3967 indicates that N-[5-(1,3-benzothiazol-2-yl)-2-chlorophenyl]-2-(4-bromophenoxy)acetamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 51.22 Ų, N-[5-(1,3-benzothiazol-2-yl)-2-chlorophenyl]-2-(4-bromophenoxy)acetamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-[5-(1,3-benzothiazol-2-yl)-2-chlorophenyl]-2-(4-bromophenoxy)acetamide has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of N-[5-(1,3-benzothiazol-2-yl)-2-chlorophenyl]-2-(4-bromophenoxy)acetamide?
The CAS number of N-[5-(1,3-benzothiazol-2-yl)-2-chlorophenyl]-2-(4-bromophenoxy)acetamide is 6451-57-6.
What is the molecular formula of N-[5-(1,3-benzothiazol-2-yl)-2-chlorophenyl]-2-(4-bromophenoxy)acetamide?
The molecular formula of N-[5-(1,3-benzothiazol-2-yl)-2-chlorophenyl]-2-(4-bromophenoxy)acetamide is C21H14BrClN2O2S.
What is the molecular weight of N-[5-(1,3-benzothiazol-2-yl)-2-chlorophenyl]-2-(4-bromophenoxy)acetamide?
The molecular weight of N-[5-(1,3-benzothiazol-2-yl)-2-chlorophenyl]-2-(4-bromophenoxy)acetamide is 471.96 g/mol.
Where can I buy N-[5-(1,3-benzothiazol-2-yl)-2-chlorophenyl]-2-(4-bromophenoxy)acetamide?
You can request a quote for N-[5-(1,3-benzothiazol-2-yl)-2-chlorophenyl]-2-(4-bromophenoxy)acetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[5-(1,3-benzothiazol-2-yl)-2-chlorophenyl]-2-(4-bromophenoxy)acetamide?
Yes, KEHONG BIO provides custom synthesis services for N-[5-(1,3-benzothiazol-2-yl)-2-chlorophenyl]-2-(4-bromophenoxy)acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.