![N-[2-(benzylsulfanyl)-1,3-benzothiazol-6-yl]-3-phenylpropanamide structure](/static/products/530/530134-48-6.png)
N-[2-(benzylsulfanyl)-1,3-benzothiazol-6-yl]-3-phenylpropanamide
TL;DR: N-[2-(benzylsulfanyl)-1,3-benzothiazol-6-yl]-3-phenylpropanamide (CAS 530134-48-6) is a chemical compound with molecular formula C23H20N2OS2 and molecular weight 404.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2-benzylsulfanyl-1,3-benzothiazol-6-yl)-3-phenylpropanamide
Also Known As: N-(2-(benzylthio)benzo[d]thiazol-6-yl)-3-phenylpropanamide, N-(2-benzylsulfanyl-1,3-benzothiazol-6-yl)-3-phenylpropanamide, N-[2-(benzylsulfanyl)-1,3-benzothiazol-6-yl]-3-phenylpropanamide
| Molecular Formula | C23H20N2OS2 |
|---|---|
| Molecular Weight | 404.10 g/mol |
| LogP | 6.1599 |
| Topological Polar Surface Area | 41.99 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 404.1017 |
| Heavy Atoms | 28 |
| Complexity | 1061.8722 |
Chemical Identifiers
| CAS Number | 530134-48-6 |
|---|---|
| SMILES | C1=CC=C(C=C1)CCC(=O)NC2=CC3=C(C=C2)N=C(S3)SCC4=CC=CC=C4 |
Product Overview
N-[2-(benzylsulfanyl)-1,3-benzothiazol-6-yl]-3-phenylpropanamide (CAS 530134-48-6), with molecular formula C23H20N2OS2 and molecular weight 404.10 g/mol. IUPAC: N-(2-benzylsulfanyl-1,3-benzothiazol-6-yl)-3-phenylpropanamide.
Chemical Property Profile of N-[2-(benzylsulfanyl)-1,3-benzothiazol-6-yl]-3-phenylpropanamide
Property Insights of N-[2-(benzylsulfanyl)-1,3-benzothiazol-6-yl]-3-phenylpropanamide
The XLogP value of 6.1599 indicates that N-[2-(benzylsulfanyl)-1,3-benzothiazol-6-yl]-3-phenylpropanamide 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-(benzylsulfanyl)-1,3-benzothiazol-6-yl]-3-phenylpropanamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-[2-(benzylsulfanyl)-1,3-benzothiazol-6-yl]-3-phenylpropanamide 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 N-[2-(benzylsulfanyl)-1,3-benzothiazol-6-yl]-3-phenylpropanamide?
The CAS number of N-[2-(benzylsulfanyl)-1,3-benzothiazol-6-yl]-3-phenylpropanamide is 530134-48-6.
What is the molecular formula of N-[2-(benzylsulfanyl)-1,3-benzothiazol-6-yl]-3-phenylpropanamide?
The molecular formula of N-[2-(benzylsulfanyl)-1,3-benzothiazol-6-yl]-3-phenylpropanamide is C23H20N2OS2.
What is the molecular weight of N-[2-(benzylsulfanyl)-1,3-benzothiazol-6-yl]-3-phenylpropanamide?
The molecular weight of N-[2-(benzylsulfanyl)-1,3-benzothiazol-6-yl]-3-phenylpropanamide is 404.10 g/mol.
Where can I buy N-[2-(benzylsulfanyl)-1,3-benzothiazol-6-yl]-3-phenylpropanamide?
You can request a quote for N-[2-(benzylsulfanyl)-1,3-benzothiazol-6-yl]-3-phenylpropanamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[2-(benzylsulfanyl)-1,3-benzothiazol-6-yl]-3-phenylpropanamide?
Yes, KEHONG BIO provides custom synthesis services for N-[2-(benzylsulfanyl)-1,3-benzothiazol-6-yl]-3-phenylpropanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.