1-(4-Iodophenyl)sulfanyl-4-nitrobenzene
TL;DR: 1-(4-Iodophenyl)sulfanyl-4-nitrobenzene (CAS 7500-08-5) is a chemical compound with molecular formula C12H8INO2S and molecular weight 356.93 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-iodophenyl)sulfanyl-4-nitrobenzene
Also Known As: 1-(4-iodophenyl)sulfanyl-4-nitrobenzene, 4-iodo-4'-nitrodiphenyl sulfide, (4-iodophenyl)(4-nitrophenyl)sulfane, (4-iodophenyl)(4-nitrophenyl)thioether, 1-iodo-4-(4-nitrophenyl)sulfanyl-benzene
| Molecular Formula | C12H8INO2S |
|---|---|
| Molecular Weight | 356.93 g/mol |
| LogP | 4.5 |
| Topological Polar Surface Area | 71.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 356.93204 |
| Heavy Atoms | 17 |
| Complexity | 256.0 |
Chemical Identifiers
| CAS Number | 7500-08-5 |
|---|---|
| SMILES | C1=CC(=CC=C1[N+](=O)[O-])SC2=CC=C(C=C2)I |
| InChIKey | HLOAJYJIDPTHJT-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-(4-Iodophenyl)sulfanyl-4-nitrobenzene (CAS 7500-08-5), with molecular formula C12H8INO2S and molecular weight 356.93 g/mol. IUPAC: 1-(4-iodophenyl)sulfanyl-4-nitrobenzene.
Chemical Property Profile of 1-(4-Iodophenyl)sulfanyl-4-nitrobenzene
Property Insights of 1-(4-Iodophenyl)sulfanyl-4-nitrobenzene
The XLogP value of 4.5 indicates that 1-(4-Iodophenyl)sulfanyl-4-nitrobenzene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 71.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(4-Iodophenyl)sulfanyl-4-nitrobenzene. Following Lipinski's Rule of Five, 1-(4-Iodophenyl)sulfanyl-4-nitrobenzene has 0 hydrogen bond donor(s) and 3 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 1-(4-Iodophenyl)sulfanyl-4-nitrobenzene?
The CAS number of 1-(4-Iodophenyl)sulfanyl-4-nitrobenzene is 7500-08-5.
What is the molecular formula of 1-(4-Iodophenyl)sulfanyl-4-nitrobenzene?
The molecular formula of 1-(4-Iodophenyl)sulfanyl-4-nitrobenzene is C12H8INO2S.
What is the molecular weight of 1-(4-Iodophenyl)sulfanyl-4-nitrobenzene?
The molecular weight of 1-(4-Iodophenyl)sulfanyl-4-nitrobenzene is 356.93 g/mol.
Where can I buy 1-(4-Iodophenyl)sulfanyl-4-nitrobenzene?
You can request a quote for 1-(4-Iodophenyl)sulfanyl-4-nitrobenzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(4-Iodophenyl)sulfanyl-4-nitrobenzene?
Yes, KEHONG BIO provides custom synthesis services for 1-(4-Iodophenyl)sulfanyl-4-nitrobenzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.