2-(Cinnamylsulfanyl)-1,3-benzothiazol-6-yl ethyl ether
TL;DR: 2-(Cinnamylsulfanyl)-1,3-benzothiazol-6-yl ethyl ether (CAS 324774-73-4) is a chemical compound with molecular formula C18H17NOS2 and molecular weight 327.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-ethoxy-2-[(E)-3-phenylprop-2-enyl]sulfanyl-1,3-benzothiazole
Also Known As: 2-(cinnamylsulfanyl)-1,3-benzothiazol-6-yl ethyl ether, BIM-0034210.P001, AI-204/31680047, 6-ethoxy-2-[(E)-3-phenylprop-2-enyl]sulfanyl-1,3-benzothiazole
| Molecular Formula | C18H17NOS2 |
|---|---|
| Molecular Weight | 327.08 g/mol |
| LogP | 5.5005 |
| Topological Polar Surface Area | 22.12 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 327.07516 |
| Heavy Atoms | 22 |
| Complexity | 765.11304 |
Chemical Identifiers
| CAS Number | 324774-73-4 |
|---|---|
| SMILES | CCOC1=CC2=C(C=C1)N=C(S2)SC/C=C/C3=CC=CC=C3 |
Product Overview
2-(Cinnamylsulfanyl)-1,3-benzothiazol-6-yl ethyl ether (CAS 324774-73-4), with molecular formula C18H17NOS2 and molecular weight 327.08 g/mol. IUPAC: 6-ethoxy-2-[(E)-3-phenylprop-2-enyl]sulfanyl-1,3-benzothiazole.
Chemical Property Profile of 2-(Cinnamylsulfanyl)-1,3-benzothiazol-6-yl ethyl ether
Property Insights of 2-(Cinnamylsulfanyl)-1,3-benzothiazol-6-yl ethyl ether
The XLogP value of 5.5005 indicates that 2-(Cinnamylsulfanyl)-1,3-benzothiazol-6-yl ethyl ether is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 22.12 Ų, 2-(Cinnamylsulfanyl)-1,3-benzothiazol-6-yl ethyl ether exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(Cinnamylsulfanyl)-1,3-benzothiazol-6-yl ethyl ether has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-(Cinnamylsulfanyl)-1,3-benzothiazol-6-yl ethyl ether?
The CAS number of 2-(Cinnamylsulfanyl)-1,3-benzothiazol-6-yl ethyl ether is 324774-73-4.
What is the molecular formula of 2-(Cinnamylsulfanyl)-1,3-benzothiazol-6-yl ethyl ether?
The molecular formula of 2-(Cinnamylsulfanyl)-1,3-benzothiazol-6-yl ethyl ether is C18H17NOS2.
What is the molecular weight of 2-(Cinnamylsulfanyl)-1,3-benzothiazol-6-yl ethyl ether?
The molecular weight of 2-(Cinnamylsulfanyl)-1,3-benzothiazol-6-yl ethyl ether is 327.08 g/mol.
Where can I buy 2-(Cinnamylsulfanyl)-1,3-benzothiazol-6-yl ethyl ether?
You can request a quote for 2-(Cinnamylsulfanyl)-1,3-benzothiazol-6-yl ethyl ether directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(Cinnamylsulfanyl)-1,3-benzothiazol-6-yl ethyl ether?
Yes, KEHONG BIO provides custom synthesis services for 2-(Cinnamylsulfanyl)-1,3-benzothiazol-6-yl ethyl ether and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.