2,4-Dibromophenyl 4-(acetylamino)benzenesulfonate
TL;DR: 2,4-Dibromophenyl 4-(acetylamino)benzenesulfonate (CAS 486440-27-1) is a chemical compound with molecular formula C14H11Br2NO4S and molecular weight 446.88 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2,4-dibromophenyl) 4-acetamidobenzenesulfonate
Also Known As: 2,4-dibromophenyl 4-(acetylamino)benzenesulfonate, (2,4-dibromophenyl) 4-acetamidobenzenesulfonate, AN-652/40633814
| Molecular Formula | C14H11Br2NO4S |
|---|---|
| Molecular Weight | 446.88 g/mol |
| LogP | 3.9377 |
| Topological Polar Surface Area | 72.47 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 446.87756 |
| Heavy Atoms | 22 |
| Complexity | 804.0926 |
Chemical Identifiers
| CAS Number | 486440-27-1 |
|---|---|
| SMILES | CC(=O)NC1=CC=C(C=C1)S(=O)(=O)OC2=C(C=C(C=C2)Br)Br |
Product Overview
2,4-Dibromophenyl 4-(acetylamino)benzenesulfonate (CAS 486440-27-1), with molecular formula C14H11Br2NO4S and molecular weight 446.88 g/mol. IUPAC: (2,4-dibromophenyl) 4-acetamidobenzenesulfonate.
Chemical Property Profile of 2,4-Dibromophenyl 4-(acetylamino)benzenesulfonate
Property Insights of 2,4-Dibromophenyl 4-(acetylamino)benzenesulfonate
The XLogP value of 3.9377 indicates that 2,4-Dibromophenyl 4-(acetylamino)benzenesulfonate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 72.47 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,4-Dibromophenyl 4-(acetylamino)benzenesulfonate. Following Lipinski's Rule of Five, 2,4-Dibromophenyl 4-(acetylamino)benzenesulfonate has 1 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 2,4-Dibromophenyl 4-(acetylamino)benzenesulfonate?
The CAS number of 2,4-Dibromophenyl 4-(acetylamino)benzenesulfonate is 486440-27-1.
What is the molecular formula of 2,4-Dibromophenyl 4-(acetylamino)benzenesulfonate?
The molecular formula of 2,4-Dibromophenyl 4-(acetylamino)benzenesulfonate is C14H11Br2NO4S.
What is the molecular weight of 2,4-Dibromophenyl 4-(acetylamino)benzenesulfonate?
The molecular weight of 2,4-Dibromophenyl 4-(acetylamino)benzenesulfonate is 446.88 g/mol.
Where can I buy 2,4-Dibromophenyl 4-(acetylamino)benzenesulfonate?
You can request a quote for 2,4-Dibromophenyl 4-(acetylamino)benzenesulfonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,4-Dibromophenyl 4-(acetylamino)benzenesulfonate?
Yes, KEHONG BIO provides custom synthesis services for 2,4-Dibromophenyl 4-(acetylamino)benzenesulfonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.