N-(6-chloro-1,3-benzothiazol-2-yl)-2-ethoxybenzamide
TL;DR: N-(6-chloro-1,3-benzothiazol-2-yl)-2-ethoxybenzamide (CAS 314023-01-3) is a chemical compound with molecular formula C16H13ClN2O2S and molecular weight 332.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(6-chloro-1,3-benzothiazol-2-yl)-2-ethoxybenzamide
Also Known As: N-(6-chloro-1,3-benzothiazol-2-yl)-2-ethoxybenzamide, BAS 00540684, N-(6-Chloro-benzothiazol-2-yl)-2-ethoxy-benzamide, N-(6-chlorobenzothiazol-2-yl)(2-ethoxyphenyl)carboxamide
| Molecular Formula | C16H13ClN2O2S |
|---|---|
| Molecular Weight | 332.04 g/mol |
| LogP | 4.5 |
| Topological Polar Surface Area | 79.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 332.03864 |
| Heavy Atoms | 22 |
| Complexity | 398.0 |
Chemical Identifiers
| CAS Number | 314023-01-3 |
|---|---|
| SMILES | CCOC1=CC=CC=C1C(=O)NC2=NC3=C(S2)C=C(C=C3)Cl |
| InChIKey | MXKLCOKFQSDIRL-UHFFFAOYSA-N |
Product Overview
N-(6-chloro-1,3-benzothiazol-2-yl)-2-ethoxybenzamide (CAS 314023-01-3), with molecular formula C16H13ClN2O2S and molecular weight 332.04 g/mol. IUPAC: N-(6-chloro-1,3-benzothiazol-2-yl)-2-ethoxybenzamide.
Chemical Property Profile of N-(6-chloro-1,3-benzothiazol-2-yl)-2-ethoxybenzamide
Property Insights of N-(6-chloro-1,3-benzothiazol-2-yl)-2-ethoxybenzamide
The XLogP value of 4.5 indicates that N-(6-chloro-1,3-benzothiazol-2-yl)-2-ethoxybenzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 79.5 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(6-chloro-1,3-benzothiazol-2-yl)-2-ethoxybenzamide. Following Lipinski's Rule of Five, N-(6-chloro-1,3-benzothiazol-2-yl)-2-ethoxybenzamide has 1 hydrogen bond donor(s) and 4 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 N-(6-chloro-1,3-benzothiazol-2-yl)-2-ethoxybenzamide?
The CAS number of N-(6-chloro-1,3-benzothiazol-2-yl)-2-ethoxybenzamide is 314023-01-3.
What is the molecular formula of N-(6-chloro-1,3-benzothiazol-2-yl)-2-ethoxybenzamide?
The molecular formula of N-(6-chloro-1,3-benzothiazol-2-yl)-2-ethoxybenzamide is C16H13ClN2O2S.
What is the molecular weight of N-(6-chloro-1,3-benzothiazol-2-yl)-2-ethoxybenzamide?
The molecular weight of N-(6-chloro-1,3-benzothiazol-2-yl)-2-ethoxybenzamide is 332.04 g/mol.
Where can I buy N-(6-chloro-1,3-benzothiazol-2-yl)-2-ethoxybenzamide?
You can request a quote for N-(6-chloro-1,3-benzothiazol-2-yl)-2-ethoxybenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(6-chloro-1,3-benzothiazol-2-yl)-2-ethoxybenzamide?
Yes, KEHONG BIO provides custom synthesis services for N-(6-chloro-1,3-benzothiazol-2-yl)-2-ethoxybenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.