(2E)-N-[2-(butylsulfanyl)-1,3-benzothiazol-6-yl]-3-phenylprop-2-enamide
TL;DR: (2E)-N-[2-(butylsulfanyl)-1,3-benzothiazol-6-yl]-3-phenylprop-2-enamide (CAS 577984-08-8) is a chemical compound with molecular formula C20H20N2OS2 and molecular weight 368.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-N-(2-butylsulfanyl-1,3-benzothiazol-6-yl)-3-phenylprop-2-enamide
Also Known As: N-(2-(butylthio)benzo[d]thiazol-6-yl)cinnamamide, (2E)-N-[2-(butylsulfanyl)-1,3-benzothiazol-6-yl]-3-phenylprop-2-enamide, (E)-N-(2-butylsulfanyl-1,3-benzothiazol-6-yl)-3-phenylprop-2-enamide
| Molecular Formula | C20H20N2OS2 |
|---|---|
| Molecular Weight | 368.10 g/mol |
| LogP | 5.8404 |
| Topological Polar Surface Area | 41.99 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 368.1017 |
| Heavy Atoms | 25 |
| Complexity | 871.79333 |
Chemical Identifiers
| CAS Number | 577984-08-8 |
|---|---|
| SMILES | CCCCSC1=NC2=C(S1)C=C(C=C2)NC(=O)/C=C/C3=CC=CC=C3 |
Product Overview
(2E)-N-[2-(butylsulfanyl)-1,3-benzothiazol-6-yl]-3-phenylprop-2-enamide (CAS 577984-08-8), with molecular formula C20H20N2OS2 and molecular weight 368.10 g/mol. IUPAC: (E)-N-(2-butylsulfanyl-1,3-benzothiazol-6-yl)-3-phenylprop-2-enamide.
Chemical Property Profile of (2E)-N-[2-(butylsulfanyl)-1,3-benzothiazol-6-yl]-3-phenylprop-2-enamide
Property Insights of (2E)-N-[2-(butylsulfanyl)-1,3-benzothiazol-6-yl]-3-phenylprop-2-enamide
The XLogP value of 5.8404 indicates that (2E)-N-[2-(butylsulfanyl)-1,3-benzothiazol-6-yl]-3-phenylprop-2-enamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 41.99 Ų, (2E)-N-[2-(butylsulfanyl)-1,3-benzothiazol-6-yl]-3-phenylprop-2-enamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (2E)-N-[2-(butylsulfanyl)-1,3-benzothiazol-6-yl]-3-phenylprop-2-enamide has 1 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 (2E)-N-[2-(butylsulfanyl)-1,3-benzothiazol-6-yl]-3-phenylprop-2-enamide?
The CAS number of (2E)-N-[2-(butylsulfanyl)-1,3-benzothiazol-6-yl]-3-phenylprop-2-enamide is 577984-08-8.
What is the molecular formula of (2E)-N-[2-(butylsulfanyl)-1,3-benzothiazol-6-yl]-3-phenylprop-2-enamide?
The molecular formula of (2E)-N-[2-(butylsulfanyl)-1,3-benzothiazol-6-yl]-3-phenylprop-2-enamide is C20H20N2OS2.
What is the molecular weight of (2E)-N-[2-(butylsulfanyl)-1,3-benzothiazol-6-yl]-3-phenylprop-2-enamide?
The molecular weight of (2E)-N-[2-(butylsulfanyl)-1,3-benzothiazol-6-yl]-3-phenylprop-2-enamide is 368.10 g/mol.
Where can I buy (2E)-N-[2-(butylsulfanyl)-1,3-benzothiazol-6-yl]-3-phenylprop-2-enamide?
You can request a quote for (2E)-N-[2-(butylsulfanyl)-1,3-benzothiazol-6-yl]-3-phenylprop-2-enamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2E)-N-[2-(butylsulfanyl)-1,3-benzothiazol-6-yl]-3-phenylprop-2-enamide?
Yes, KEHONG BIO provides custom synthesis services for (2E)-N-[2-(butylsulfanyl)-1,3-benzothiazol-6-yl]-3-phenylprop-2-enamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.