![N-[2-(benzylsulfanyl)-1,3-benzothiazol-6-yl]-2,2-dimethylpropanamide structure](/static/products/845/845653-29-4.png)
N-[2-(benzylsulfanyl)-1,3-benzothiazol-6-yl]-2,2-dimethylpropanamide
TL;DR: N-[2-(benzylsulfanyl)-1,3-benzothiazol-6-yl]-2,2-dimethylpropanamide (CAS 845653-29-4) is a chemical compound with molecular formula C19H20N2OS2 and molecular weight 356.10 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)-2,2-dimethylpropanamide
Also Known As: N-(2-(benzylthio)benzo[d]thiazol-6-yl)pivalamide, D336-4987, N-[2-(benzylsulfanyl)-1,3-benzothiazol-6-yl]-2,2-dimethylpropanamide, N-(2-benzylsulfanyl-1,3-benzothiazol-6-yl)-2,2-dimethylpropanamide
| Molecular Formula | C19H20N2OS2 |
|---|---|
| Molecular Weight | 356.10 g/mol |
| LogP | 5.5732 |
| Topological Polar Surface Area | 41.99 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 356.1017 |
| Heavy Atoms | 24 |
| Complexity | 850.6793 |
Chemical Identifiers
| CAS Number | 845653-29-4 |
|---|---|
| SMILES | CC(C)(C)C(=O)NC1=CC2=C(C=C1)N=C(S2)SCC3=CC=CC=C3 |
Product Overview
N-[2-(benzylsulfanyl)-1,3-benzothiazol-6-yl]-2,2-dimethylpropanamide (CAS 845653-29-4), with molecular formula C19H20N2OS2 and molecular weight 356.10 g/mol. IUPAC: N-(2-benzylsulfanyl-1,3-benzothiazol-6-yl)-2,2-dimethylpropanamide.
Chemical Property Profile of N-[2-(benzylsulfanyl)-1,3-benzothiazol-6-yl]-2,2-dimethylpropanamide
Property Insights of N-[2-(benzylsulfanyl)-1,3-benzothiazol-6-yl]-2,2-dimethylpropanamide
The XLogP value of 5.5732 indicates that N-[2-(benzylsulfanyl)-1,3-benzothiazol-6-yl]-2,2-dimethylpropanamide 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]-2,2-dimethylpropanamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-[2-(benzylsulfanyl)-1,3-benzothiazol-6-yl]-2,2-dimethylpropanamide 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]-2,2-dimethylpropanamide?
The CAS number of N-[2-(benzylsulfanyl)-1,3-benzothiazol-6-yl]-2,2-dimethylpropanamide is 845653-29-4.
What is the molecular formula of N-[2-(benzylsulfanyl)-1,3-benzothiazol-6-yl]-2,2-dimethylpropanamide?
The molecular formula of N-[2-(benzylsulfanyl)-1,3-benzothiazol-6-yl]-2,2-dimethylpropanamide is C19H20N2OS2.
What is the molecular weight of N-[2-(benzylsulfanyl)-1,3-benzothiazol-6-yl]-2,2-dimethylpropanamide?
The molecular weight of N-[2-(benzylsulfanyl)-1,3-benzothiazol-6-yl]-2,2-dimethylpropanamide is 356.10 g/mol.
Where can I buy N-[2-(benzylsulfanyl)-1,3-benzothiazol-6-yl]-2,2-dimethylpropanamide?
You can request a quote for N-[2-(benzylsulfanyl)-1,3-benzothiazol-6-yl]-2,2-dimethylpropanamide 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]-2,2-dimethylpropanamide?
Yes, KEHONG BIO provides custom synthesis services for N-[2-(benzylsulfanyl)-1,3-benzothiazol-6-yl]-2,2-dimethylpropanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.