4-butoxy-N-(2-((2-methyl-1H-indol-3-yl)thio)ethyl)benzamide
TL;DR: 4-butoxy-N-(2-((2-methyl-1H-indol-3-yl)thio)ethyl)benzamide (CAS 687574-98-7) is a chemical compound with molecular formula C22H26N2O2S and molecular weight 382.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-butoxy-N-[2-[(2-methyl-1H-indol-3-yl)sulfanyl]ethyl]benzamide
Also Known As: 4-butoxy-N-(2-((2-methyl-1H-indol-3-yl)thio)ethyl)benzamide, F0582-0187, 4-butoxy-N-[2-[(2-methyl-1H-indol-3-yl)sulfanyl]ethyl]benzamide, 4-butoxy-N-{2-[(2-methyl-1H-indol-3-yl)sulfanyl]ethyl}benzamide
| Molecular Formula | C22H26N2O2S |
|---|---|
| Molecular Weight | 382.17 g/mol |
| LogP | 5.17732 |
| Topological Polar Surface Area | 54.12 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 9 |
| Exact Mass | 382.1715 |
| Heavy Atoms | 27 |
| Complexity | 886.9691 |
Chemical Identifiers
| CAS Number | 687574-98-7 |
|---|---|
| SMILES | CCCCOC1=CC=C(C=C1)C(=O)NCCSC2=C(NC3=CC=CC=C32)C |
Product Overview
4-butoxy-N-(2-((2-methyl-1H-indol-3-yl)thio)ethyl)benzamide (CAS 687574-98-7), with molecular formula C22H26N2O2S and molecular weight 382.17 g/mol. IUPAC: 4-butoxy-N-[2-[(2-methyl-1H-indol-3-yl)sulfanyl]ethyl]benzamide.
Chemical Property Profile of 4-butoxy-N-(2-((2-methyl-1H-indol-3-yl)thio)ethyl)benzamide
Property Insights of 4-butoxy-N-(2-((2-methyl-1H-indol-3-yl)thio)ethyl)benzamide
The XLogP value of 5.17732 indicates that 4-butoxy-N-(2-((2-methyl-1H-indol-3-yl)thio)ethyl)benzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.12 Ų, 4-butoxy-N-(2-((2-methyl-1H-indol-3-yl)thio)ethyl)benzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-butoxy-N-(2-((2-methyl-1H-indol-3-yl)thio)ethyl)benzamide has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4-butoxy-N-(2-((2-methyl-1H-indol-3-yl)thio)ethyl)benzamide?
The CAS number of 4-butoxy-N-(2-((2-methyl-1H-indol-3-yl)thio)ethyl)benzamide is 687574-98-7.
What is the molecular formula of 4-butoxy-N-(2-((2-methyl-1H-indol-3-yl)thio)ethyl)benzamide?
The molecular formula of 4-butoxy-N-(2-((2-methyl-1H-indol-3-yl)thio)ethyl)benzamide is C22H26N2O2S.
What is the molecular weight of 4-butoxy-N-(2-((2-methyl-1H-indol-3-yl)thio)ethyl)benzamide?
The molecular weight of 4-butoxy-N-(2-((2-methyl-1H-indol-3-yl)thio)ethyl)benzamide is 382.17 g/mol.
Where can I buy 4-butoxy-N-(2-((2-methyl-1H-indol-3-yl)thio)ethyl)benzamide?
You can request a quote for 4-butoxy-N-(2-((2-methyl-1H-indol-3-yl)thio)ethyl)benzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-butoxy-N-(2-((2-methyl-1H-indol-3-yl)thio)ethyl)benzamide?
Yes, KEHONG BIO provides custom synthesis services for 4-butoxy-N-(2-((2-methyl-1H-indol-3-yl)thio)ethyl)benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.