![N-{2-[(2-bromobenzyl)sulfanyl]-1,3-benzothiazol-6-yl}acetamide structure](/static/products/6932/693230-01-2.webp)
N-{2-[(2-bromobenzyl)sulfanyl]-1,3-benzothiazol-6-yl}acetamide
TL;DR: N-{2-[(2-bromobenzyl)sulfanyl]-1,3-benzothiazol-6-yl}acetamide (CAS 693230-01-2) is a chemical compound with molecular formula C16H13BrN2OS2 and molecular weight 391.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[2-[(2-bromophenyl)methylsulfanyl]-1,3-benzothiazol-6-yl]acetamide
Also Known As: N-{2-[(2-bromobenzyl)sulfanyl]-1,3-benzothiazol-6-yl}acetamide, N-[2-[(2-bromophenyl)methylsulfanyl]-1,3-benzothiazol-6-yl]acetamide
| Molecular Formula | C16H13BrN2OS2 |
|---|---|
| Molecular Weight | 391.97 g/mol |
| LogP | 5.3095 |
| Topological Polar Surface Area | 41.99 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 391.96527 |
| Heavy Atoms | 22 |
| Complexity | 831.8788 |
Chemical Identifiers
| CAS Number | 693230-01-2 |
|---|---|
| SMILES | CC(=O)NC1=CC2=C(C=C1)N=C(S2)SCC3=CC=CC=C3Br |
Product Overview
N-{2-[(2-bromobenzyl)sulfanyl]-1,3-benzothiazol-6-yl}acetamide (CAS 693230-01-2), with molecular formula C16H13BrN2OS2 and molecular weight 391.97 g/mol. IUPAC: N-[2-[(2-bromophenyl)methylsulfanyl]-1,3-benzothiazol-6-yl]acetamide.
Chemical Property Profile of N-{2-[(2-bromobenzyl)sulfanyl]-1,3-benzothiazol-6-yl}acetamide
Property Insights of N-{2-[(2-bromobenzyl)sulfanyl]-1,3-benzothiazol-6-yl}acetamide
The XLogP value of 5.3095 indicates that N-{2-[(2-bromobenzyl)sulfanyl]-1,3-benzothiazol-6-yl}acetamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 41.99 Ų, N-{2-[(2-bromobenzyl)sulfanyl]-1,3-benzothiazol-6-yl}acetamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-{2-[(2-bromobenzyl)sulfanyl]-1,3-benzothiazol-6-yl}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-{2-[(2-bromobenzyl)sulfanyl]-1,3-benzothiazol-6-yl}acetamide?
The CAS number of N-{2-[(2-bromobenzyl)sulfanyl]-1,3-benzothiazol-6-yl}acetamide is 693230-01-2.
What is the molecular formula of N-{2-[(2-bromobenzyl)sulfanyl]-1,3-benzothiazol-6-yl}acetamide?
The molecular formula of N-{2-[(2-bromobenzyl)sulfanyl]-1,3-benzothiazol-6-yl}acetamide is C16H13BrN2OS2.
What is the molecular weight of N-{2-[(2-bromobenzyl)sulfanyl]-1,3-benzothiazol-6-yl}acetamide?
The molecular weight of N-{2-[(2-bromobenzyl)sulfanyl]-1,3-benzothiazol-6-yl}acetamide is 391.97 g/mol.
Where can I buy N-{2-[(2-bromobenzyl)sulfanyl]-1,3-benzothiazol-6-yl}acetamide?
You can request a quote for N-{2-[(2-bromobenzyl)sulfanyl]-1,3-benzothiazol-6-yl}acetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-{2-[(2-bromobenzyl)sulfanyl]-1,3-benzothiazol-6-yl}acetamide?
Yes, KEHONG BIO provides custom synthesis services for N-{2-[(2-bromobenzyl)sulfanyl]-1,3-benzothiazol-6-yl}acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.