2-({2,4-bisnitrobenzyl}sulfanyl)-1H-indole
TL;DR: 2-({2,4-bisnitrobenzyl}sulfanyl)-1H-indole (CAS 353263-22-6) is a chemical compound with molecular formula C15H11N3O4S and molecular weight 329.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(2,4-dinitrophenyl)methylsulfanyl]-1H-indole
Also Known As: 2-({2,4-bisnitrobenzyl}sulfanyl)-1H-indole, 2-[(2,4-dinitrophenyl)methylsulfanyl]-1H-indole, AI-204/31730040
| Molecular Formula | C15H11N3O4S |
|---|---|
| Molecular Weight | 329.05 g/mol |
| LogP | 4.2766 |
| Topological Polar Surface Area | 102.07 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 329.04703 |
| Heavy Atoms | 23 |
| Complexity | 873.6283 |
Chemical Identifiers
| CAS Number | 353263-22-6 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C=C(N2)SCC3=C(C=C(C=C3)[N+](=O)[O-])[N+](=O)[O-] |
Product Overview
2-({2,4-bisnitrobenzyl}sulfanyl)-1H-indole (CAS 353263-22-6), with molecular formula C15H11N3O4S and molecular weight 329.05 g/mol. IUPAC: 2-[(2,4-dinitrophenyl)methylsulfanyl]-1H-indole.
Chemical Property Profile of 2-({2,4-bisnitrobenzyl}sulfanyl)-1H-indole
Property Insights of 2-({2,4-bisnitrobenzyl}sulfanyl)-1H-indole
The XLogP value of 4.2766 indicates that 2-({2,4-bisnitrobenzyl}sulfanyl)-1H-indole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 102.07 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-({2,4-bisnitrobenzyl}sulfanyl)-1H-indole. Following Lipinski's Rule of Five, 2-({2,4-bisnitrobenzyl}sulfanyl)-1H-indole has 1 hydrogen bond donor(s) and 5 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-({2,4-bisnitrobenzyl}sulfanyl)-1H-indole?
The CAS number of 2-({2,4-bisnitrobenzyl}sulfanyl)-1H-indole is 353263-22-6.
What is the molecular formula of 2-({2,4-bisnitrobenzyl}sulfanyl)-1H-indole?
The molecular formula of 2-({2,4-bisnitrobenzyl}sulfanyl)-1H-indole is C15H11N3O4S.
What is the molecular weight of 2-({2,4-bisnitrobenzyl}sulfanyl)-1H-indole?
The molecular weight of 2-({2,4-bisnitrobenzyl}sulfanyl)-1H-indole is 329.05 g/mol.
Where can I buy 2-({2,4-bisnitrobenzyl}sulfanyl)-1H-indole?
You can request a quote for 2-({2,4-bisnitrobenzyl}sulfanyl)-1H-indole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-({2,4-bisnitrobenzyl}sulfanyl)-1H-indole?
Yes, KEHONG BIO provides custom synthesis services for 2-({2,4-bisnitrobenzyl}sulfanyl)-1H-indole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.