N-(6-bromo-1,3-benzothiazol-2-yl)-4-butoxybenzamide
TL;DR: N-(6-bromo-1,3-benzothiazol-2-yl)-4-butoxybenzamide (CAS 15864-21-8) is a chemical compound with molecular formula C18H17BrN2O2S and molecular weight 404.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(6-bromo-1,3-benzothiazol-2-yl)-4-butoxybenzamide
Also Known As: N-(6-bromo-1,3-benzothiazol-2-yl)-4-butoxybenzamide, N-(6-bromobenzo[d]thiazol-2-yl)-4-butoxybenzamide, N-(6-bromobenzothiazol-2-yl)-4-butoxy-benzamide, F0007-0811
| Molecular Formula | C18H17BrN2O2S |
|---|---|
| Molecular Weight | 404.02 g/mol |
| LogP | 5.49 |
| Topological Polar Surface Area | 51.22 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 404.0194 |
| Heavy Atoms | 24 |
| Complexity | 845.85095 |
Chemical Identifiers
| CAS Number | 15864-21-8 |
|---|---|
| SMILES | CCCCOC1=CC=C(C=C1)C(=O)NC2=NC3=C(S2)C=C(C=C3)Br |
Product Overview
N-(6-bromo-1,3-benzothiazol-2-yl)-4-butoxybenzamide (CAS 15864-21-8), with molecular formula C18H17BrN2O2S and molecular weight 404.02 g/mol. IUPAC: N-(6-bromo-1,3-benzothiazol-2-yl)-4-butoxybenzamide.
Chemical Property Profile of N-(6-bromo-1,3-benzothiazol-2-yl)-4-butoxybenzamide
Property Insights of N-(6-bromo-1,3-benzothiazol-2-yl)-4-butoxybenzamide
The XLogP value of 5.49 indicates that N-(6-bromo-1,3-benzothiazol-2-yl)-4-butoxybenzamide 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-(6-bromo-1,3-benzothiazol-2-yl)-4-butoxybenzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(6-bromo-1,3-benzothiazol-2-yl)-4-butoxybenzamide 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-(6-bromo-1,3-benzothiazol-2-yl)-4-butoxybenzamide?
The CAS number of N-(6-bromo-1,3-benzothiazol-2-yl)-4-butoxybenzamide is 15864-21-8.
What is the molecular formula of N-(6-bromo-1,3-benzothiazol-2-yl)-4-butoxybenzamide?
The molecular formula of N-(6-bromo-1,3-benzothiazol-2-yl)-4-butoxybenzamide is C18H17BrN2O2S.
What is the molecular weight of N-(6-bromo-1,3-benzothiazol-2-yl)-4-butoxybenzamide?
The molecular weight of N-(6-bromo-1,3-benzothiazol-2-yl)-4-butoxybenzamide is 404.02 g/mol.
Where can I buy N-(6-bromo-1,3-benzothiazol-2-yl)-4-butoxybenzamide?
You can request a quote for N-(6-bromo-1,3-benzothiazol-2-yl)-4-butoxybenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(6-bromo-1,3-benzothiazol-2-yl)-4-butoxybenzamide?
Yes, KEHONG BIO provides custom synthesis services for N-(6-bromo-1,3-benzothiazol-2-yl)-4-butoxybenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.