![2-[(4-chlorobenzyl)sulfanyl]-1-methyl-1H-indole-3-carbaldehyde structure](/static/products/3384/338416-58-3.webp)
2-[(4-chlorobenzyl)sulfanyl]-1-methyl-1H-indole-3-carbaldehyde
TL;DR: 2-[(4-chlorobenzyl)sulfanyl]-1-methyl-1H-indole-3-carbaldehyde (CAS 338416-58-3) is a chemical compound with molecular formula C17H14ClNOS and molecular weight 315.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(4-chlorophenyl)methylsulfanyl]-1-methylindole-3-carbaldehyde
Also Known As: 2-[(4-chlorobenzyl)sulfanyl]-1-methyl-1H-indole-3-carbaldehyde, 2-((4-Chlorobenzyl)thio)-1-methyl-1H-indole-3-carbaldehyde, 3N-328S, chlorobenzylsulfanylmethylindolecarbaldehyde, 2-{[(4-chlorophenyl)methyl]sulfanyl}-1-methyl-1H-indole-3-carbaldehyde
| Molecular Formula | C17H14ClNOS |
|---|---|
| Molecular Weight | 315.05 g/mol |
| LogP | 4.9365 |
| Topological Polar Surface Area | 22.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 315.04846 |
| Heavy Atoms | 21 |
| Complexity | 792.40533 |
Chemical Identifiers
| CAS Number | 338416-58-3 |
|---|---|
| SMILES | CN1C2=CC=CC=C2C(=C1SCC3=CC=C(C=C3)Cl)C=O |
Product Overview
2-[(4-chlorobenzyl)sulfanyl]-1-methyl-1H-indole-3-carbaldehyde (CAS 338416-58-3), with molecular formula C17H14ClNOS and molecular weight 315.05 g/mol. IUPAC: 2-[(4-chlorophenyl)methylsulfanyl]-1-methylindole-3-carbaldehyde.
Chemical Property Profile of 2-[(4-chlorobenzyl)sulfanyl]-1-methyl-1H-indole-3-carbaldehyde
Property Insights of 2-[(4-chlorobenzyl)sulfanyl]-1-methyl-1H-indole-3-carbaldehyde
The XLogP value of 4.9365 indicates that 2-[(4-chlorobenzyl)sulfanyl]-1-methyl-1H-indole-3-carbaldehyde is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 22.0 Ų, 2-[(4-chlorobenzyl)sulfanyl]-1-methyl-1H-indole-3-carbaldehyde exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-[(4-chlorobenzyl)sulfanyl]-1-methyl-1H-indole-3-carbaldehyde has 0 hydrogen bond donor(s) and 2 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-[(4-chlorobenzyl)sulfanyl]-1-methyl-1H-indole-3-carbaldehyde?
The CAS number of 2-[(4-chlorobenzyl)sulfanyl]-1-methyl-1H-indole-3-carbaldehyde is 338416-58-3.
What is the molecular formula of 2-[(4-chlorobenzyl)sulfanyl]-1-methyl-1H-indole-3-carbaldehyde?
The molecular formula of 2-[(4-chlorobenzyl)sulfanyl]-1-methyl-1H-indole-3-carbaldehyde is C17H14ClNOS.
What is the molecular weight of 2-[(4-chlorobenzyl)sulfanyl]-1-methyl-1H-indole-3-carbaldehyde?
The molecular weight of 2-[(4-chlorobenzyl)sulfanyl]-1-methyl-1H-indole-3-carbaldehyde is 315.05 g/mol.
Where can I buy 2-[(4-chlorobenzyl)sulfanyl]-1-methyl-1H-indole-3-carbaldehyde?
You can request a quote for 2-[(4-chlorobenzyl)sulfanyl]-1-methyl-1H-indole-3-carbaldehyde directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[(4-chlorobenzyl)sulfanyl]-1-methyl-1H-indole-3-carbaldehyde?
Yes, KEHONG BIO provides custom synthesis services for 2-[(4-chlorobenzyl)sulfanyl]-1-methyl-1H-indole-3-carbaldehyde and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.