4-ethoxy-N-(3-methyl-1,3-benzothiazol-2(3H)-ylidene)aniline
TL;DR: 4-ethoxy-N-(3-methyl-1,3-benzothiazol-2(3H)-ylidene)aniline (CAS 666820-76-4) is a chemical compound with molecular formula C16H16N2OS and molecular weight 284.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(4-ethoxyphenyl)-3-methyl-1,3-benzothiazol-2-imine
Also Known As: 4-ethoxy-N-(3-methyl-1,3-benzothiazol-2(3H)-ylidene)aniline, AN-689/41741261, N-(4-ethoxyphenyl)-3-methyl-1,3-benzothiazol-2-imine
| Molecular Formula | C16H16N2OS |
|---|---|
| Molecular Weight | 284.10 g/mol |
| LogP | 3.8709 |
| Topological Polar Surface Area | 26.52 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 284.09833 |
| Heavy Atoms | 20 |
| Complexity | 784.0921 |
Chemical Identifiers
| CAS Number | 666820-76-4 |
|---|---|
| SMILES | CCOC1=CC=C(C=C1)N=C2N(C3=CC=CC=C3S2)C |
Product Overview
4-ethoxy-N-(3-methyl-1,3-benzothiazol-2(3H)-ylidene)aniline (CAS 666820-76-4), with molecular formula C16H16N2OS and molecular weight 284.10 g/mol. IUPAC: N-(4-ethoxyphenyl)-3-methyl-1,3-benzothiazol-2-imine.
Chemical Property Profile of 4-ethoxy-N-(3-methyl-1,3-benzothiazol-2(3H)-ylidene)aniline
Property Insights of 4-ethoxy-N-(3-methyl-1,3-benzothiazol-2(3H)-ylidene)aniline
The XLogP value of 3.8709 indicates that 4-ethoxy-N-(3-methyl-1,3-benzothiazol-2(3H)-ylidene)aniline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.52 Ų, 4-ethoxy-N-(3-methyl-1,3-benzothiazol-2(3H)-ylidene)aniline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-ethoxy-N-(3-methyl-1,3-benzothiazol-2(3H)-ylidene)aniline has 0 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-ethoxy-N-(3-methyl-1,3-benzothiazol-2(3H)-ylidene)aniline?
The CAS number of 4-ethoxy-N-(3-methyl-1,3-benzothiazol-2(3H)-ylidene)aniline is 666820-76-4.
What is the molecular formula of 4-ethoxy-N-(3-methyl-1,3-benzothiazol-2(3H)-ylidene)aniline?
The molecular formula of 4-ethoxy-N-(3-methyl-1,3-benzothiazol-2(3H)-ylidene)aniline is C16H16N2OS.
What is the molecular weight of 4-ethoxy-N-(3-methyl-1,3-benzothiazol-2(3H)-ylidene)aniline?
The molecular weight of 4-ethoxy-N-(3-methyl-1,3-benzothiazol-2(3H)-ylidene)aniline is 284.10 g/mol.
Where can I buy 4-ethoxy-N-(3-methyl-1,3-benzothiazol-2(3H)-ylidene)aniline?
You can request a quote for 4-ethoxy-N-(3-methyl-1,3-benzothiazol-2(3H)-ylidene)aniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-ethoxy-N-(3-methyl-1,3-benzothiazol-2(3H)-ylidene)aniline?
Yes, KEHONG BIO provides custom synthesis services for 4-ethoxy-N-(3-methyl-1,3-benzothiazol-2(3H)-ylidene)aniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.