1-(4-Nitrophenyl)-2-phenylsulfanylethanone
TL;DR: 1-(4-Nitrophenyl)-2-phenylsulfanylethanone (CAS 36734-52-8) is a chemical compound with molecular formula C14H11NO3S and molecular weight 273.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-nitrophenyl)-2-phenylsulfanylethanone
Also Known As: 1-(4-nitrophenyl)-2-phenylsulfanylethanone, 1-(4-nitrophenyl)-2-(phenylsulfanyl)ethanone, 1-(4-nitrophenyl)-2-phenylsulfanyl-ethanone, 1-(4-Nitro-phenyl)-2-phenylmercapto-aethanon, 1-(4-nitro-phenyl)-2-phenylsulfanyl-ethanone
| Molecular Formula | C14H11NO3S |
|---|---|
| Molecular Weight | 273.05 g/mol |
| LogP | 3.5698 |
| Topological Polar Surface Area | 60.21 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 273.04596 |
| Heavy Atoms | 19 |
| Complexity | 581.3999 |
Chemical Identifiers
| CAS Number | 36734-52-8 |
|---|---|
| SMILES | C1=CC=C(C=C1)SCC(=O)C2=CC=C(C=C2)[N+](=O)[O-] |
Product Overview
1-(4-Nitrophenyl)-2-phenylsulfanylethanone (CAS 36734-52-8), with molecular formula C14H11NO3S and molecular weight 273.05 g/mol. IUPAC: 1-(4-nitrophenyl)-2-phenylsulfanylethanone.
Chemical Property Profile of 1-(4-Nitrophenyl)-2-phenylsulfanylethanone
Property Insights of 1-(4-Nitrophenyl)-2-phenylsulfanylethanone
The XLogP value of 3.5698 indicates that 1-(4-Nitrophenyl)-2-phenylsulfanylethanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 60.21 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(4-Nitrophenyl)-2-phenylsulfanylethanone. Following Lipinski's Rule of Five, 1-(4-Nitrophenyl)-2-phenylsulfanylethanone has 0 hydrogen bond donor(s) and 4 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-Nitrophenyl)-2-phenylsulfanylethanone?
The CAS number of 1-(4-Nitrophenyl)-2-phenylsulfanylethanone is 36734-52-8.
What is the molecular formula of 1-(4-Nitrophenyl)-2-phenylsulfanylethanone?
The molecular formula of 1-(4-Nitrophenyl)-2-phenylsulfanylethanone is C14H11NO3S.
What is the molecular weight of 1-(4-Nitrophenyl)-2-phenylsulfanylethanone?
The molecular weight of 1-(4-Nitrophenyl)-2-phenylsulfanylethanone is 273.05 g/mol.
Where can I buy 1-(4-Nitrophenyl)-2-phenylsulfanylethanone?
You can request a quote for 1-(4-Nitrophenyl)-2-phenylsulfanylethanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(4-Nitrophenyl)-2-phenylsulfanylethanone?
Yes, KEHONG BIO provides custom synthesis services for 1-(4-Nitrophenyl)-2-phenylsulfanylethanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.