![N-{2-[(3-methylbutyl)sulfanyl]-1,3-benzothiazol-6-yl}-2-phenoxyacetamide structure](/static/products/577/577960-06-6.png)
N-{2-[(3-methylbutyl)sulfanyl]-1,3-benzothiazol-6-yl}-2-phenoxyacetamide
TL;DR: N-{2-[(3-methylbutyl)sulfanyl]-1,3-benzothiazol-6-yl}-2-phenoxyacetamide (CAS 577960-06-6) is a chemical compound with molecular formula C20H22N2O2S2 and molecular weight 386.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[2-(3-methylbutylsulfanyl)-1,3-benzothiazol-6-yl]-2-phenoxyacetamide
Also Known As: N-(2-(isopentylthio)benzo[d]thiazol-6-yl)-2-phenoxyacetamide, N-[2-(3-methylbutylsulfanyl)-1,3-benzothiazol-6-yl]-2-phenoxyacetamide, N-{2-[(3-methylbutyl)sulfanyl]-1,3-benzothiazol-6-yl}-2-phenoxyacetamide
| Molecular Formula | C20H22N2O2S2 |
|---|---|
| Molecular Weight | 386.11 g/mol |
| LogP | 5.452 |
| Topological Polar Surface Area | 51.22 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 386.11227 |
| Heavy Atoms | 26 |
| Complexity | 862.6335 |
Chemical Identifiers
| CAS Number | 577960-06-6 |
|---|---|
| SMILES | CC(C)CCSC1=NC2=C(S1)C=C(C=C2)NC(=O)COC3=CC=CC=C3 |
Product Overview
N-{2-[(3-methylbutyl)sulfanyl]-1,3-benzothiazol-6-yl}-2-phenoxyacetamide (CAS 577960-06-6), with molecular formula C20H22N2O2S2 and molecular weight 386.11 g/mol. IUPAC: N-[2-(3-methylbutylsulfanyl)-1,3-benzothiazol-6-yl]-2-phenoxyacetamide.
Chemical Property Profile of N-{2-[(3-methylbutyl)sulfanyl]-1,3-benzothiazol-6-yl}-2-phenoxyacetamide
Property Insights of N-{2-[(3-methylbutyl)sulfanyl]-1,3-benzothiazol-6-yl}-2-phenoxyacetamide
The XLogP value of 5.452 indicates that N-{2-[(3-methylbutyl)sulfanyl]-1,3-benzothiazol-6-yl}-2-phenoxyacetamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 51.22 Ų, N-{2-[(3-methylbutyl)sulfanyl]-1,3-benzothiazol-6-yl}-2-phenoxyacetamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-{2-[(3-methylbutyl)sulfanyl]-1,3-benzothiazol-6-yl}-2-phenoxyacetamide has 1 hydrogen bond donor(s) and 5 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-[(3-methylbutyl)sulfanyl]-1,3-benzothiazol-6-yl}-2-phenoxyacetamide?
The CAS number of N-{2-[(3-methylbutyl)sulfanyl]-1,3-benzothiazol-6-yl}-2-phenoxyacetamide is 577960-06-6.
What is the molecular formula of N-{2-[(3-methylbutyl)sulfanyl]-1,3-benzothiazol-6-yl}-2-phenoxyacetamide?
The molecular formula of N-{2-[(3-methylbutyl)sulfanyl]-1,3-benzothiazol-6-yl}-2-phenoxyacetamide is C20H22N2O2S2.
What is the molecular weight of N-{2-[(3-methylbutyl)sulfanyl]-1,3-benzothiazol-6-yl}-2-phenoxyacetamide?
The molecular weight of N-{2-[(3-methylbutyl)sulfanyl]-1,3-benzothiazol-6-yl}-2-phenoxyacetamide is 386.11 g/mol.
Where can I buy N-{2-[(3-methylbutyl)sulfanyl]-1,3-benzothiazol-6-yl}-2-phenoxyacetamide?
You can request a quote for N-{2-[(3-methylbutyl)sulfanyl]-1,3-benzothiazol-6-yl}-2-phenoxyacetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-{2-[(3-methylbutyl)sulfanyl]-1,3-benzothiazol-6-yl}-2-phenoxyacetamide?
Yes, KEHONG BIO provides custom synthesis services for N-{2-[(3-methylbutyl)sulfanyl]-1,3-benzothiazol-6-yl}-2-phenoxyacetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.