2-((1-(3-fluorobenzyl)-1H-indol-3-yl)thio)-N-(p-tolyl)acetamide
TL;DR: 2-((1-(3-fluorobenzyl)-1H-indol-3-yl)thio)-N-(p-tolyl)acetamide (CAS 450347-11-2) is a chemical compound with molecular formula C24H21FN2OS and molecular weight 404.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[1-[(3-fluorophenyl)methyl]indol-3-yl]sulfanyl-N-(4-methylphenyl)acetamide
Also Known As: 2-((1-(3-fluorobenzyl)-1H-indol-3-yl)thio)-N-(p-tolyl)acetamide, 2-({1-[(3-fluorophenyl)methyl]-1H-indol-3-yl}sulfanyl)-N-(4-methylphenyl)acetamide, 2-[1-[(3-fluorophenyl)methyl]indol-3-yl]sulfanyl-N-(4-methylphenyl)acetamide, F0545-0281
| Molecular Formula | C24H21FN2OS |
|---|---|
| Molecular Weight | 404.14 g/mol |
| LogP | 5.86792 |
| Topological Polar Surface Area | 34.03 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Exact Mass | 404.13586 |
| Heavy Atoms | 29 |
| Complexity | 1151.2344 |
Chemical Identifiers
| CAS Number | 450347-11-2 |
|---|---|
| SMILES | CC1=CC=C(C=C1)NC(=O)CSC2=CN(C3=CC=CC=C32)CC4=CC(=CC=C4)F |
Product Overview
2-((1-(3-fluorobenzyl)-1H-indol-3-yl)thio)-N-(p-tolyl)acetamide (CAS 450347-11-2), with molecular formula C24H21FN2OS and molecular weight 404.14 g/mol. IUPAC: 2-[1-[(3-fluorophenyl)methyl]indol-3-yl]sulfanyl-N-(4-methylphenyl)acetamide.
Chemical Property Profile of 2-((1-(3-fluorobenzyl)-1H-indol-3-yl)thio)-N-(p-tolyl)acetamide
Property Insights of 2-((1-(3-fluorobenzyl)-1H-indol-3-yl)thio)-N-(p-tolyl)acetamide
The XLogP value of 5.86792 indicates that 2-((1-(3-fluorobenzyl)-1H-indol-3-yl)thio)-N-(p-tolyl)acetamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 34.03 Ų, 2-((1-(3-fluorobenzyl)-1H-indol-3-yl)thio)-N-(p-tolyl)acetamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-((1-(3-fluorobenzyl)-1H-indol-3-yl)thio)-N-(p-tolyl)acetamide has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-((1-(3-fluorobenzyl)-1H-indol-3-yl)thio)-N-(p-tolyl)acetamide?
The CAS number of 2-((1-(3-fluorobenzyl)-1H-indol-3-yl)thio)-N-(p-tolyl)acetamide is 450347-11-2.
What is the molecular formula of 2-((1-(3-fluorobenzyl)-1H-indol-3-yl)thio)-N-(p-tolyl)acetamide?
The molecular formula of 2-((1-(3-fluorobenzyl)-1H-indol-3-yl)thio)-N-(p-tolyl)acetamide is C24H21FN2OS.
What is the molecular weight of 2-((1-(3-fluorobenzyl)-1H-indol-3-yl)thio)-N-(p-tolyl)acetamide?
The molecular weight of 2-((1-(3-fluorobenzyl)-1H-indol-3-yl)thio)-N-(p-tolyl)acetamide is 404.14 g/mol.
Where can I buy 2-((1-(3-fluorobenzyl)-1H-indol-3-yl)thio)-N-(p-tolyl)acetamide?
You can request a quote for 2-((1-(3-fluorobenzyl)-1H-indol-3-yl)thio)-N-(p-tolyl)acetamide 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-fluorobenzyl)-1H-indol-3-yl)thio)-N-(p-tolyl)acetamide?
Yes, KEHONG BIO provides custom synthesis services for 2-((1-(3-fluorobenzyl)-1H-indol-3-yl)thio)-N-(p-tolyl)acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.