3-butoxy-N-(6-chloro-1,3-benzothiazol-2-yl)benzamide
TL;DR: 3-butoxy-N-(6-chloro-1,3-benzothiazol-2-yl)benzamide (CAS 477553-77-8) is a chemical compound with molecular formula C18H17ClN2O2S and molecular weight 360.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-butoxy-N-(6-chloro-1,3-benzothiazol-2-yl)benzamide
Also Known As: 3-butoxy-N-(6-chloro-1,3-benzothiazol-2-yl)benzamide
| Molecular Formula | C18H17ClN2O2S |
|---|---|
| Molecular Weight | 360.07 g/mol |
| LogP | 5.3809 |
| Topological Polar Surface Area | 51.22 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 360.06992 |
| Heavy Atoms | 24 |
| Complexity | 863.10095 |
Chemical Identifiers
| CAS Number | 477553-77-8 |
|---|---|
| SMILES | CCCCOC1=CC=CC(=C1)C(=O)NC2=NC3=C(S2)C=C(C=C3)Cl |
Product Overview
3-butoxy-N-(6-chloro-1,3-benzothiazol-2-yl)benzamide (CAS 477553-77-8), with molecular formula C18H17ClN2O2S and molecular weight 360.07 g/mol. IUPAC: 3-butoxy-N-(6-chloro-1,3-benzothiazol-2-yl)benzamide.
Chemical Property Profile of 3-butoxy-N-(6-chloro-1,3-benzothiazol-2-yl)benzamide
Property Insights of 3-butoxy-N-(6-chloro-1,3-benzothiazol-2-yl)benzamide
The XLogP value of 5.3809 indicates that 3-butoxy-N-(6-chloro-1,3-benzothiazol-2-yl)benzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 51.22 Ų, 3-butoxy-N-(6-chloro-1,3-benzothiazol-2-yl)benzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-butoxy-N-(6-chloro-1,3-benzothiazol-2-yl)benzamide 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 3-butoxy-N-(6-chloro-1,3-benzothiazol-2-yl)benzamide?
The CAS number of 3-butoxy-N-(6-chloro-1,3-benzothiazol-2-yl)benzamide is 477553-77-8.
What is the molecular formula of 3-butoxy-N-(6-chloro-1,3-benzothiazol-2-yl)benzamide?
The molecular formula of 3-butoxy-N-(6-chloro-1,3-benzothiazol-2-yl)benzamide is C18H17ClN2O2S.
What is the molecular weight of 3-butoxy-N-(6-chloro-1,3-benzothiazol-2-yl)benzamide?
The molecular weight of 3-butoxy-N-(6-chloro-1,3-benzothiazol-2-yl)benzamide is 360.07 g/mol.
Where can I buy 3-butoxy-N-(6-chloro-1,3-benzothiazol-2-yl)benzamide?
You can request a quote for 3-butoxy-N-(6-chloro-1,3-benzothiazol-2-yl)benzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-butoxy-N-(6-chloro-1,3-benzothiazol-2-yl)benzamide?
Yes, KEHONG BIO provides custom synthesis services for 3-butoxy-N-(6-chloro-1,3-benzothiazol-2-yl)benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.