1-Bromo-4-((2-nitro-1-phenylethyl)sulfonyl)benzene
TL;DR: 1-Bromo-4-((2-nitro-1-phenylethyl)sulfonyl)benzene (CAS 52265-15-3) is a chemical compound with molecular formula C14H12BrNO4S and molecular weight 368.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-bromo-4-(2-nitro-1-phenylethyl)sulfonylbenzene
Also Known As: 1-bromo-4-((2-nitro-1-phenylethyl)sulfonyl)benzene, 1-bromo-4-[(2-nitro-1-phenylethyl)sulfonyl]benzene, 1-bromo-4-(2-nitro-1-phenylethyl)sulfonylbenzene, 1-[(4-bromophenyl)sulfonyl]-2-nitro-1-phenylethane
| Molecular Formula | C14H12BrNO4S |
|---|---|
| Molecular Weight | 368.97 g/mol |
| LogP | 3.2408 |
| Topological Polar Surface Area | 77.28 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 368.96704 |
| Heavy Atoms | 21 |
| Complexity | 729.32916 |
Chemical Identifiers
| CAS Number | 52265-15-3 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(C[N+](=O)[O-])S(=O)(=O)C2=CC=C(C=C2)Br |
Product Overview
1-Bromo-4-((2-nitro-1-phenylethyl)sulfonyl)benzene (CAS 52265-15-3), with molecular formula C14H12BrNO4S and molecular weight 368.97 g/mol. IUPAC: 1-bromo-4-(2-nitro-1-phenylethyl)sulfonylbenzene.
Chemical Property Profile of 1-Bromo-4-((2-nitro-1-phenylethyl)sulfonyl)benzene
Property Insights of 1-Bromo-4-((2-nitro-1-phenylethyl)sulfonyl)benzene
The XLogP value of 3.2408 indicates that 1-Bromo-4-((2-nitro-1-phenylethyl)sulfonyl)benzene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 77.28 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-Bromo-4-((2-nitro-1-phenylethyl)sulfonyl)benzene. Following Lipinski's Rule of Five, 1-Bromo-4-((2-nitro-1-phenylethyl)sulfonyl)benzene 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-Bromo-4-((2-nitro-1-phenylethyl)sulfonyl)benzene?
The CAS number of 1-Bromo-4-((2-nitro-1-phenylethyl)sulfonyl)benzene is 52265-15-3.
What is the molecular formula of 1-Bromo-4-((2-nitro-1-phenylethyl)sulfonyl)benzene?
The molecular formula of 1-Bromo-4-((2-nitro-1-phenylethyl)sulfonyl)benzene is C14H12BrNO4S.
What is the molecular weight of 1-Bromo-4-((2-nitro-1-phenylethyl)sulfonyl)benzene?
The molecular weight of 1-Bromo-4-((2-nitro-1-phenylethyl)sulfonyl)benzene is 368.97 g/mol.
Where can I buy 1-Bromo-4-((2-nitro-1-phenylethyl)sulfonyl)benzene?
You can request a quote for 1-Bromo-4-((2-nitro-1-phenylethyl)sulfonyl)benzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Bromo-4-((2-nitro-1-phenylethyl)sulfonyl)benzene?
Yes, KEHONG BIO provides custom synthesis services for 1-Bromo-4-((2-nitro-1-phenylethyl)sulfonyl)benzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.