2-(1,3-benzothiazol-2-ylsulfanyl)-N-butylacetamide
TL;DR: 2-(1,3-benzothiazol-2-ylsulfanyl)-N-butylacetamide (CAS 16907-22-5) is a chemical compound with molecular formula C13H16N2OS2 and molecular weight 280.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(1,3-benzothiazol-2-ylsulfanyl)-N-butylacetamide
Also Known As: 2-(1,3-benzothiazol-2-ylsulfanyl)-N-butylacetamide
| Molecular Formula | C13H16N2OS2 |
|---|---|
| Molecular Weight | 280.07 g/mol |
| LogP | 3.3047 |
| Topological Polar Surface Area | 41.99 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 280.0704 |
| Heavy Atoms | 18 |
| Complexity | 491.44052 |
Chemical Identifiers
| CAS Number | 16907-22-5 |
|---|---|
| SMILES | CCCCNC(=O)CSC1=NC2=CC=CC=C2S1 |
Product Overview
2-(1,3-benzothiazol-2-ylsulfanyl)-N-butylacetamide (CAS 16907-22-5), with molecular formula C13H16N2OS2 and molecular weight 280.07 g/mol. IUPAC: 2-(1,3-benzothiazol-2-ylsulfanyl)-N-butylacetamide.
Chemical Property Profile of 2-(1,3-benzothiazol-2-ylsulfanyl)-N-butylacetamide
Property Insights of 2-(1,3-benzothiazol-2-ylsulfanyl)-N-butylacetamide
The XLogP value of 3.3047 indicates that 2-(1,3-benzothiazol-2-ylsulfanyl)-N-butylacetamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 41.99 Ų, 2-(1,3-benzothiazol-2-ylsulfanyl)-N-butylacetamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(1,3-benzothiazol-2-ylsulfanyl)-N-butylacetamide has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-(1,3-benzothiazol-2-ylsulfanyl)-N-butylacetamide?
The CAS number of 2-(1,3-benzothiazol-2-ylsulfanyl)-N-butylacetamide is 16907-22-5.
What is the molecular formula of 2-(1,3-benzothiazol-2-ylsulfanyl)-N-butylacetamide?
The molecular formula of 2-(1,3-benzothiazol-2-ylsulfanyl)-N-butylacetamide is C13H16N2OS2.
What is the molecular weight of 2-(1,3-benzothiazol-2-ylsulfanyl)-N-butylacetamide?
The molecular weight of 2-(1,3-benzothiazol-2-ylsulfanyl)-N-butylacetamide is 280.07 g/mol.
Where can I buy 2-(1,3-benzothiazol-2-ylsulfanyl)-N-butylacetamide?
You can request a quote for 2-(1,3-benzothiazol-2-ylsulfanyl)-N-butylacetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(1,3-benzothiazol-2-ylsulfanyl)-N-butylacetamide?
Yes, KEHONG BIO provides custom synthesis services for 2-(1,3-benzothiazol-2-ylsulfanyl)-N-butylacetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.