4-ethyl-N-(6-methyl-1,3-benzothiazol-2-yl)benzamide
TL;DR: 4-ethyl-N-(6-methyl-1,3-benzothiazol-2-yl)benzamide (CAS 313227-00-8) is a chemical compound with molecular formula C17H16N2OS and molecular weight 296.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-ethyl-N-(6-methyl-1,3-benzothiazol-2-yl)benzamide
Also Known As: 4-ethyl-N-(6-methyl-1,3-benzothiazol-2-yl)benzamide, AO-548/11108004
| Molecular Formula | C17H16N2OS |
|---|---|
| Molecular Weight | 296.10 g/mol |
| LogP | 4.7 |
| Topological Polar Surface Area | 70.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 296.09833 |
| Heavy Atoms | 21 |
| Complexity | 368.0 |
Chemical Identifiers
| CAS Number | 313227-00-8 |
|---|---|
| SMILES | CCC1=CC=C(C=C1)C(=O)NC2=NC3=C(S2)C=C(C=C3)C |
| InChIKey | LGQCKAPXSKKJEO-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-ethyl-N-(6-methyl-1,3-benzothiazol-2-yl)benzamide (CAS 313227-00-8), with molecular formula C17H16N2OS and molecular weight 296.10 g/mol. IUPAC: 4-ethyl-N-(6-methyl-1,3-benzothiazol-2-yl)benzamide.
Chemical Property Profile of 4-ethyl-N-(6-methyl-1,3-benzothiazol-2-yl)benzamide
Property Insights of 4-ethyl-N-(6-methyl-1,3-benzothiazol-2-yl)benzamide
The XLogP value of 4.7 indicates that 4-ethyl-N-(6-methyl-1,3-benzothiazol-2-yl)benzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 70.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-ethyl-N-(6-methyl-1,3-benzothiazol-2-yl)benzamide. Following Lipinski's Rule of Five, 4-ethyl-N-(6-methyl-1,3-benzothiazol-2-yl)benzamide has 1 hydrogen bond donor(s) and 3 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 4-ethyl-N-(6-methyl-1,3-benzothiazol-2-yl)benzamide?
The CAS number of 4-ethyl-N-(6-methyl-1,3-benzothiazol-2-yl)benzamide is 313227-00-8.
What is the molecular formula of 4-ethyl-N-(6-methyl-1,3-benzothiazol-2-yl)benzamide?
The molecular formula of 4-ethyl-N-(6-methyl-1,3-benzothiazol-2-yl)benzamide is C17H16N2OS.
What is the molecular weight of 4-ethyl-N-(6-methyl-1,3-benzothiazol-2-yl)benzamide?
The molecular weight of 4-ethyl-N-(6-methyl-1,3-benzothiazol-2-yl)benzamide is 296.10 g/mol.
Where can I buy 4-ethyl-N-(6-methyl-1,3-benzothiazol-2-yl)benzamide?
You can request a quote for 4-ethyl-N-(6-methyl-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 4-ethyl-N-(6-methyl-1,3-benzothiazol-2-yl)benzamide?
Yes, KEHONG BIO provides custom synthesis services for 4-ethyl-N-(6-methyl-1,3-benzothiazol-2-yl)benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.