4-Bromo-2-[(4-naphthalen-2-ylsulfonylpiperazin-1-yl)methyl]phenol
TL;DR: 4-Bromo-2-[(4-naphthalen-2-ylsulfonylpiperazin-1-yl)methyl]phenol (CAS 428830-38-0) is a chemical compound with molecular formula C21H21BrN2O3S and molecular weight 460.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-bromo-2-[(4-naphthalen-2-ylsulfonylpiperazin-1-yl)methyl]phenol
Also Known As: 4-bromo-2-[(4-naphthalen-2-ylsulfonylpiperazin-1-yl)methyl]phenol, 4-BROMO-2-{[4-(2-NAPHTHYLSULFONYL)PIPERAZINO]METHYL}PHENOL, 4-bromo-2-{[4-(naphthalen-2-ylsulfonyl)piperazin-1-yl]methyl}phenol
| Molecular Formula | C21H21BrN2O3S |
|---|---|
| Molecular Weight | 460.05 g/mol |
| LogP | 3.8144 |
| Topological Polar Surface Area | 60.85 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 460.04562 |
| Heavy Atoms | 28 |
| Complexity | 1109.5887 |
Chemical Identifiers
| CAS Number | 428830-38-0 |
|---|---|
| SMILES | C1CN(CCN1CC2=C(C=CC(=C2)Br)O)S(=O)(=O)C3=CC4=CC=CC=C4C=C3 |
Product Overview
4-Bromo-2-[(4-naphthalen-2-ylsulfonylpiperazin-1-yl)methyl]phenol (CAS 428830-38-0), with molecular formula C21H21BrN2O3S and molecular weight 460.05 g/mol. IUPAC: 4-bromo-2-[(4-naphthalen-2-ylsulfonylpiperazin-1-yl)methyl]phenol.
Chemical Property Profile of 4-Bromo-2-[(4-naphthalen-2-ylsulfonylpiperazin-1-yl)methyl]phenol
Property Insights of 4-Bromo-2-[(4-naphthalen-2-ylsulfonylpiperazin-1-yl)methyl]phenol
The XLogP value of 3.8144 indicates that 4-Bromo-2-[(4-naphthalen-2-ylsulfonylpiperazin-1-yl)methyl]phenol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 60.85 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Bromo-2-[(4-naphthalen-2-ylsulfonylpiperazin-1-yl)methyl]phenol. Following Lipinski's Rule of Five, 4-Bromo-2-[(4-naphthalen-2-ylsulfonylpiperazin-1-yl)methyl]phenol 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 4-Bromo-2-[(4-naphthalen-2-ylsulfonylpiperazin-1-yl)methyl]phenol?
The CAS number of 4-Bromo-2-[(4-naphthalen-2-ylsulfonylpiperazin-1-yl)methyl]phenol is 428830-38-0.
What is the molecular formula of 4-Bromo-2-[(4-naphthalen-2-ylsulfonylpiperazin-1-yl)methyl]phenol?
The molecular formula of 4-Bromo-2-[(4-naphthalen-2-ylsulfonylpiperazin-1-yl)methyl]phenol is C21H21BrN2O3S.
What is the molecular weight of 4-Bromo-2-[(4-naphthalen-2-ylsulfonylpiperazin-1-yl)methyl]phenol?
The molecular weight of 4-Bromo-2-[(4-naphthalen-2-ylsulfonylpiperazin-1-yl)methyl]phenol is 460.05 g/mol.
Where can I buy 4-Bromo-2-[(4-naphthalen-2-ylsulfonylpiperazin-1-yl)methyl]phenol?
You can request a quote for 4-Bromo-2-[(4-naphthalen-2-ylsulfonylpiperazin-1-yl)methyl]phenol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Bromo-2-[(4-naphthalen-2-ylsulfonylpiperazin-1-yl)methyl]phenol?
Yes, KEHONG BIO provides custom synthesis services for 4-Bromo-2-[(4-naphthalen-2-ylsulfonylpiperazin-1-yl)methyl]phenol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.