![2-(Benzenesulfonyl)-3-[2-(4-bromophenoxy)-5-nitro-phenyl]prop-2-enenitrile structure](/static/products/1025/1025301-02-3.webp)
2-(Benzenesulfonyl)-3-[2-(4-bromophenoxy)-5-nitro-phenyl]prop-2-enenitrile
TL;DR: 2-(Benzenesulfonyl)-3-[2-(4-bromophenoxy)-5-nitro-phenyl]prop-2-enenitrile (CAS 1025301-02-3) is a chemical compound with molecular formula C21H13BrN2O5S and molecular weight 483.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(benzenesulfonyl)-3-[2-(4-bromophenoxy)-5-nitrophenyl]prop-2-enenitrile
Also Known As: 3-(2-(4-BROMOPHENOXY)-5-NITROPHENYL)-2-(PHENYLSULFONYL)PROP-2-ENENITRILE, 2-(benzenesulfonyl)-3-[2-(4-bromophenoxy)-5-nitro-phenyl]prop-2-enenitrile, 2-(benzenesulfonyl)-3-[2-(4-bromophenoxy)-5-nitrophenyl]prop-2-enenitrile, (E)-2-(benzenesulfonyl)-3-[2-(4-bromophenoxy)-5-nitrophenyl]prop-2-enenitrile, C21H13BrN2O5S
| Molecular Formula | C21H13BrN2O5S |
|---|---|
| Molecular Weight | 483.97 g/mol |
| LogP | 5.48798 |
| Topological Polar Surface Area | 110.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 483.97287 |
| Heavy Atoms | 30 |
| Complexity | 1264.9989 |
Chemical Identifiers
| CAS Number | 1025301-02-3 |
|---|---|
| SMILES | C1=CC=C(C=C1)S(=O)(=O)C(=CC2=C(C=CC(=C2)[N+](=O)[O-])OC3=CC=C(C=C3)Br)C#N |
Product Overview
2-(Benzenesulfonyl)-3-[2-(4-bromophenoxy)-5-nitro-phenyl]prop-2-enenitrile (CAS 1025301-02-3), with molecular formula C21H13BrN2O5S and molecular weight 483.97 g/mol. IUPAC: 2-(benzenesulfonyl)-3-[2-(4-bromophenoxy)-5-nitrophenyl]prop-2-enenitrile.
Chemical Property Profile of 2-(Benzenesulfonyl)-3-[2-(4-bromophenoxy)-5-nitro-phenyl]prop-2-enenitrile
Property Insights of 2-(Benzenesulfonyl)-3-[2-(4-bromophenoxy)-5-nitro-phenyl]prop-2-enenitrile
The XLogP value of 5.48798 indicates that 2-(Benzenesulfonyl)-3-[2-(4-bromophenoxy)-5-nitro-phenyl]prop-2-enenitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 110.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(Benzenesulfonyl)-3-[2-(4-bromophenoxy)-5-nitro-phenyl]prop-2-enenitrile. Following Lipinski's Rule of Five, 2-(Benzenesulfonyl)-3-[2-(4-bromophenoxy)-5-nitro-phenyl]prop-2-enenitrile has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-(Benzenesulfonyl)-3-[2-(4-bromophenoxy)-5-nitro-phenyl]prop-2-enenitrile?
The CAS number of 2-(Benzenesulfonyl)-3-[2-(4-bromophenoxy)-5-nitro-phenyl]prop-2-enenitrile is 1025301-02-3.
What is the molecular formula of 2-(Benzenesulfonyl)-3-[2-(4-bromophenoxy)-5-nitro-phenyl]prop-2-enenitrile?
The molecular formula of 2-(Benzenesulfonyl)-3-[2-(4-bromophenoxy)-5-nitro-phenyl]prop-2-enenitrile is C21H13BrN2O5S.
What is the molecular weight of 2-(Benzenesulfonyl)-3-[2-(4-bromophenoxy)-5-nitro-phenyl]prop-2-enenitrile?
The molecular weight of 2-(Benzenesulfonyl)-3-[2-(4-bromophenoxy)-5-nitro-phenyl]prop-2-enenitrile is 483.97 g/mol.
Where can I buy 2-(Benzenesulfonyl)-3-[2-(4-bromophenoxy)-5-nitro-phenyl]prop-2-enenitrile?
You can request a quote for 2-(Benzenesulfonyl)-3-[2-(4-bromophenoxy)-5-nitro-phenyl]prop-2-enenitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(Benzenesulfonyl)-3-[2-(4-bromophenoxy)-5-nitro-phenyl]prop-2-enenitrile?
Yes, KEHONG BIO provides custom synthesis services for 2-(Benzenesulfonyl)-3-[2-(4-bromophenoxy)-5-nitro-phenyl]prop-2-enenitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.