6-(3-Ethyl-2(3H)-benzothiazolylidene)-2,4-hexadienal
TL;DR: 6-(3-Ethyl-2(3H)-benzothiazolylidene)-2,4-hexadienal (CAS 299928-40-8) is a chemical compound with molecular formula C15H15NOS and molecular weight 257.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-(3-ethyl-1,3-benzothiazol-2-ylidene)hexa-2,4-dienal
Also Known As: 6-(3-Ethyl-2(3H)-benzothiazolylidene)-2,4-hexadienal, 6-(3-ethyl-1,3-benzothiazol-2-ylidene)hexa-2,4-dienal, 6-(3-Ethyl-1,3-benzothiazol-2(3H)-ylidene)hexa-2,4-dienal
| Molecular Formula | C15H15NOS |
|---|---|
| Molecular Weight | 257.09 g/mol |
| LogP | 3.7713 |
| Topological Polar Surface Area | 20.31 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 257.08743 |
| Heavy Atoms | 18 |
| Complexity | 516.9798 |
Chemical Identifiers
| CAS Number | 299928-40-8 |
|---|---|
| SMILES | CCN1C2=CC=CC=C2SC1=CC=CC=CC=O |
Product Overview
6-(3-Ethyl-2(3H)-benzothiazolylidene)-2,4-hexadienal (CAS 299928-40-8), with molecular formula C15H15NOS and molecular weight 257.09 g/mol. IUPAC: 6-(3-ethyl-1,3-benzothiazol-2-ylidene)hexa-2,4-dienal.
Chemical Property Profile of 6-(3-Ethyl-2(3H)-benzothiazolylidene)-2,4-hexadienal
Property Insights of 6-(3-Ethyl-2(3H)-benzothiazolylidene)-2,4-hexadienal
The XLogP value of 3.7713 indicates that 6-(3-Ethyl-2(3H)-benzothiazolylidene)-2,4-hexadienal is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 20.31 Ų, 6-(3-Ethyl-2(3H)-benzothiazolylidene)-2,4-hexadienal exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-(3-Ethyl-2(3H)-benzothiazolylidene)-2,4-hexadienal 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 6-(3-Ethyl-2(3H)-benzothiazolylidene)-2,4-hexadienal?
The CAS number of 6-(3-Ethyl-2(3H)-benzothiazolylidene)-2,4-hexadienal is 299928-40-8.
What is the molecular formula of 6-(3-Ethyl-2(3H)-benzothiazolylidene)-2,4-hexadienal?
The molecular formula of 6-(3-Ethyl-2(3H)-benzothiazolylidene)-2,4-hexadienal is C15H15NOS.
What is the molecular weight of 6-(3-Ethyl-2(3H)-benzothiazolylidene)-2,4-hexadienal?
The molecular weight of 6-(3-Ethyl-2(3H)-benzothiazolylidene)-2,4-hexadienal is 257.09 g/mol.
Where can I buy 6-(3-Ethyl-2(3H)-benzothiazolylidene)-2,4-hexadienal?
You can request a quote for 6-(3-Ethyl-2(3H)-benzothiazolylidene)-2,4-hexadienal directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-(3-Ethyl-2(3H)-benzothiazolylidene)-2,4-hexadienal?
Yes, KEHONG BIO provides custom synthesis services for 6-(3-Ethyl-2(3H)-benzothiazolylidene)-2,4-hexadienal and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.