N-(6-ethoxy-1,3-benzothiazol-2-yl)-3,4-dimethylbenzamide
TL;DR: N-(6-ethoxy-1,3-benzothiazol-2-yl)-3,4-dimethylbenzamide (CAS 58822-47-2) is a chemical compound with molecular formula C18H18N2O2S and molecular weight 326.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(6-ethoxy-1,3-benzothiazol-2-yl)-3,4-dimethylbenzamide
Also Known As: N-(6-ethoxy-1,3-benzothiazol-2-yl)-3,4-dimethylbenzamide, AH-034/33495019, benzamide, n-(6-ethoxy-2-benzothiazolyl)-3,4-dimethyl-
| Molecular Formula | C18H18N2O2S |
|---|---|
| Molecular Weight | 326.11 g/mol |
| LogP | 4.6 |
| Topological Polar Surface Area | 79.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 326.1089 |
| Heavy Atoms | 23 |
| Complexity | 420.0 |
Chemical Identifiers
| CAS Number | 58822-47-2 |
|---|---|
| SMILES | CCOC1=CC2=C(C=C1)N=C(S2)NC(=O)C3=CC(=C(C=C3)C)C |
| InChIKey | SWCSRHSLSIDUOE-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N-(6-ethoxy-1,3-benzothiazol-2-yl)-3,4-dimethylbenzamide (CAS 58822-47-2), with molecular formula C18H18N2O2S and molecular weight 326.11 g/mol. IUPAC: N-(6-ethoxy-1,3-benzothiazol-2-yl)-3,4-dimethylbenzamide.
Chemical Property Profile of N-(6-ethoxy-1,3-benzothiazol-2-yl)-3,4-dimethylbenzamide
Property Insights of N-(6-ethoxy-1,3-benzothiazol-2-yl)-3,4-dimethylbenzamide
The XLogP value of 4.6 indicates that N-(6-ethoxy-1,3-benzothiazol-2-yl)-3,4-dimethylbenzamide 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-ethoxy-1,3-benzothiazol-2-yl)-3,4-dimethylbenzamide. Following Lipinski's Rule of Five, N-(6-ethoxy-1,3-benzothiazol-2-yl)-3,4-dimethylbenzamide 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-ethoxy-1,3-benzothiazol-2-yl)-3,4-dimethylbenzamide?
The CAS number of N-(6-ethoxy-1,3-benzothiazol-2-yl)-3,4-dimethylbenzamide is 58822-47-2.
What is the molecular formula of N-(6-ethoxy-1,3-benzothiazol-2-yl)-3,4-dimethylbenzamide?
The molecular formula of N-(6-ethoxy-1,3-benzothiazol-2-yl)-3,4-dimethylbenzamide is C18H18N2O2S.
What is the molecular weight of N-(6-ethoxy-1,3-benzothiazol-2-yl)-3,4-dimethylbenzamide?
The molecular weight of N-(6-ethoxy-1,3-benzothiazol-2-yl)-3,4-dimethylbenzamide is 326.11 g/mol.
Where can I buy N-(6-ethoxy-1,3-benzothiazol-2-yl)-3,4-dimethylbenzamide?
You can request a quote for N-(6-ethoxy-1,3-benzothiazol-2-yl)-3,4-dimethylbenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(6-ethoxy-1,3-benzothiazol-2-yl)-3,4-dimethylbenzamide?
Yes, KEHONG BIO provides custom synthesis services for N-(6-ethoxy-1,3-benzothiazol-2-yl)-3,4-dimethylbenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.