![2-Bromo-1-[(4-methylphenyl)sulfonylmethyl]-4-nitrobenzene structure](/static/products/5932/593272-33-4.webp)
2-Bromo-1-[(4-methylphenyl)sulfonylmethyl]-4-nitrobenzene
TL;DR: 2-Bromo-1-[(4-methylphenyl)sulfonylmethyl]-4-nitrobenzene (CAS 593272-33-4) 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.
2-bromo-1-[(4-methylphenyl)sulfonylmethyl]-4-nitrobenzene
Also Known As: 2-bromo-1-[(4-methylphenyl)sulfonylmethyl]-4-nitrobenzene, 2-bromo-1-{[(4-methylphenyl)sulfonyl]methyl}-4-nitrobenzene
| Molecular Formula | C14H12BrNO4S |
|---|---|
| Molecular Weight | 368.97 g/mol |
| LogP | 3.63962 |
| Topological Polar Surface Area | 77.28 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 368.96704 |
| Heavy Atoms | 21 |
| Complexity | 785.12134 |
Chemical Identifiers
| CAS Number | 593272-33-4 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)CC2=C(C=C(C=C2)[N+](=O)[O-])Br |
Product Overview
2-Bromo-1-[(4-methylphenyl)sulfonylmethyl]-4-nitrobenzene (CAS 593272-33-4), with molecular formula C14H12BrNO4S and molecular weight 368.97 g/mol. IUPAC: 2-bromo-1-[(4-methylphenyl)sulfonylmethyl]-4-nitrobenzene.
Chemical Property Profile of 2-Bromo-1-[(4-methylphenyl)sulfonylmethyl]-4-nitrobenzene
Property Insights of 2-Bromo-1-[(4-methylphenyl)sulfonylmethyl]-4-nitrobenzene
The XLogP value of 3.63962 indicates that 2-Bromo-1-[(4-methylphenyl)sulfonylmethyl]-4-nitrobenzene 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 2-Bromo-1-[(4-methylphenyl)sulfonylmethyl]-4-nitrobenzene. Following Lipinski's Rule of Five, 2-Bromo-1-[(4-methylphenyl)sulfonylmethyl]-4-nitrobenzene 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 2-Bromo-1-[(4-methylphenyl)sulfonylmethyl]-4-nitrobenzene?
The CAS number of 2-Bromo-1-[(4-methylphenyl)sulfonylmethyl]-4-nitrobenzene is 593272-33-4.
What is the molecular formula of 2-Bromo-1-[(4-methylphenyl)sulfonylmethyl]-4-nitrobenzene?
The molecular formula of 2-Bromo-1-[(4-methylphenyl)sulfonylmethyl]-4-nitrobenzene is C14H12BrNO4S.
What is the molecular weight of 2-Bromo-1-[(4-methylphenyl)sulfonylmethyl]-4-nitrobenzene?
The molecular weight of 2-Bromo-1-[(4-methylphenyl)sulfonylmethyl]-4-nitrobenzene is 368.97 g/mol.
Where can I buy 2-Bromo-1-[(4-methylphenyl)sulfonylmethyl]-4-nitrobenzene?
You can request a quote for 2-Bromo-1-[(4-methylphenyl)sulfonylmethyl]-4-nitrobenzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Bromo-1-[(4-methylphenyl)sulfonylmethyl]-4-nitrobenzene?
Yes, KEHONG BIO provides custom synthesis services for 2-Bromo-1-[(4-methylphenyl)sulfonylmethyl]-4-nitrobenzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.