N-(2-ethylsulfanyl-1,3-benzothiazol-6-yl)-3-methylbenzamide
TL;DR: N-(2-ethylsulfanyl-1,3-benzothiazol-6-yl)-3-methylbenzamide (CAS 578753-36-3) is a chemical compound with molecular formula C17H16N2OS2 and molecular weight 328.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2-ethylsulfanyl-1,3-benzothiazol-6-yl)-3-methylbenzamide
Also Known As: N-(2-ethylsulfanyl-1,3-benzothiazol-6-yl)-3-methylbenzamide, N-[2-(ethylsulfanyl)-1,3-benzothiazol-6-yl]-3-methylbenzamide, AO-022/14611078, N-(2-(ethylthio)benzo[d]thiazol-6-yl)-3-methylbenzamide
| Molecular Formula | C17H16N2OS2 |
|---|---|
| Molecular Weight | 328.07 g/mol |
| LogP | 4.96902 |
| Topological Polar Surface Area | 41.99 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 328.0704 |
| Heavy Atoms | 22 |
| Complexity | 826.3919 |
Chemical Identifiers
| CAS Number | 578753-36-3 |
|---|---|
| SMILES | CCSC1=NC2=C(S1)C=C(C=C2)NC(=O)C3=CC=CC(=C3)C |
Product Overview
N-(2-ethylsulfanyl-1,3-benzothiazol-6-yl)-3-methylbenzamide (CAS 578753-36-3), with molecular formula C17H16N2OS2 and molecular weight 328.07 g/mol. IUPAC: N-(2-ethylsulfanyl-1,3-benzothiazol-6-yl)-3-methylbenzamide.
Chemical Property Profile of N-(2-ethylsulfanyl-1,3-benzothiazol-6-yl)-3-methylbenzamide
Property Insights of N-(2-ethylsulfanyl-1,3-benzothiazol-6-yl)-3-methylbenzamide
The XLogP value of 4.96902 indicates that N-(2-ethylsulfanyl-1,3-benzothiazol-6-yl)-3-methylbenzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 41.99 Ų, N-(2-ethylsulfanyl-1,3-benzothiazol-6-yl)-3-methylbenzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(2-ethylsulfanyl-1,3-benzothiazol-6-yl)-3-methylbenzamide 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-(2-ethylsulfanyl-1,3-benzothiazol-6-yl)-3-methylbenzamide?
The CAS number of N-(2-ethylsulfanyl-1,3-benzothiazol-6-yl)-3-methylbenzamide is 578753-36-3.
What is the molecular formula of N-(2-ethylsulfanyl-1,3-benzothiazol-6-yl)-3-methylbenzamide?
The molecular formula of N-(2-ethylsulfanyl-1,3-benzothiazol-6-yl)-3-methylbenzamide is C17H16N2OS2.
What is the molecular weight of N-(2-ethylsulfanyl-1,3-benzothiazol-6-yl)-3-methylbenzamide?
The molecular weight of N-(2-ethylsulfanyl-1,3-benzothiazol-6-yl)-3-methylbenzamide is 328.07 g/mol.
Where can I buy N-(2-ethylsulfanyl-1,3-benzothiazol-6-yl)-3-methylbenzamide?
You can request a quote for N-(2-ethylsulfanyl-1,3-benzothiazol-6-yl)-3-methylbenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(2-ethylsulfanyl-1,3-benzothiazol-6-yl)-3-methylbenzamide?
Yes, KEHONG BIO provides custom synthesis services for N-(2-ethylsulfanyl-1,3-benzothiazol-6-yl)-3-methylbenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.