Dibromobuphenine HCl
TL;DR: Dibromobuphenine HCl (CAS 25233-47-0) is a chemical compound with molecular formula C19H24Br2ClNO2 and molecular weight 490.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,6-dibromo-4-[1-hydroxy-2-(4-phenylbutan-2-ylamino)propyl]phenol;hydrochloride
Also Known As: Dibromobuphenine HCl, Dibromobuphenine hydrochloride, 1-(3,5-Dibromo-4-hydroxyphenyl)-2-(1-methyl-3-phenylpropylamino)propanol hydrochloride, Benzyl alcohol, 3,5-dibromo-4-hydroxy-alpha-(1-((1-methyl-3-phenylpropyl)amino)ethyl)-, hydrochloride, 2,6-dibromo-4-{1-hydroxy-2-[(4-phenylbutan-2-yl)amino]propyl}phenol hydrochloride(1:1)
| Molecular Formula | C19H24Br2ClNO2 |
|---|---|
| Molecular Weight | 490.99 g/mol |
| LogP | 5.3718 |
| Topological Polar Surface Area | 52.5 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 490.98624 |
| Heavy Atoms | 25 |
| Complexity | 353.0 |
Chemical Identifiers
| CAS Number | 25233-47-0 |
|---|---|
| SMILES | CC(CCC1=CC=CC=C1)NC(C)C(C2=CC(=C(C(=C2)Br)O)Br)O.Cl |
| InChIKey | HCRXUHKRLGACNP-UHFFFAOYSA-N |
Product Overview
Dibromobuphenine HCl (CAS 25233-47-0), with molecular formula C19H24Br2ClNO2 and molecular weight 490.99 g/mol. IUPAC: 2,6-dibromo-4-[1-hydroxy-2-(4-phenylbutan-2-ylamino)propyl]phenol;hydrochloride.
Chemical Property Profile of Dibromobuphenine HCl
Property Insights of Dibromobuphenine HCl
The XLogP value of 5.3718 indicates that Dibromobuphenine HCl is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.5 Ų, Dibromobuphenine HCl exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Dibromobuphenine HCl has 4 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Dibromobuphenine HCl?
The CAS number of Dibromobuphenine HCl is 25233-47-0.
What is the molecular formula of Dibromobuphenine HCl?
The molecular formula of Dibromobuphenine HCl is C19H24Br2ClNO2.
What is the molecular weight of Dibromobuphenine HCl?
The molecular weight of Dibromobuphenine HCl is 490.99 g/mol.
Where can I buy Dibromobuphenine HCl?
You can request a quote for Dibromobuphenine HCl directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dibromobuphenine HCl?
Yes, KEHONG BIO provides custom synthesis services for Dibromobuphenine HCl and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.