5-Bromo-2-(2-hydroxy-3-((1-methylethyl)amino)propoxy)-alpha-methylbenzenemethanol
TL;DR: 5-Bromo-2-(2-hydroxy-3-((1-methylethyl)amino)propoxy)-alpha-methylbenzenemethanol (CAS 79030-59-4) is a chemical compound with molecular formula C14H22BrNO3 and molecular weight 331.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[4-bromo-2-(1-hydroxyethyl)phenoxy]-3-(propan-2-ylamino)propan-2-ol
Also Known As: 5-Bromo-2-(2-hydroxy-3-((1-methylethyl)amino)propoxy)-alpha-methylbenzenemethanol, Benzenemethanol, 5-bromo-2-(2-hydroxy-3-((1-methylethyl)amino)propoxy)-alpha-methyl-, 1-[4-bromo-2-(1-hydroxyethyl)phenoxy]-3-(propan-2-ylamino)propan-2-ol, 1-[4-Bromo-2-(1-hydroxyethyl)phenoxy]-3-[(propan-2-yl)amino]propan-2-ol, BRN 4460892
| Molecular Formula | C14H22BrNO3 |
|---|---|
| Molecular Weight | 331.08 g/mol |
| LogP | 2.2401 |
| Topological Polar Surface Area | 61.72 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 331.0783 |
| Heavy Atoms | 19 |
| Complexity | 396.2775 |
Chemical Identifiers
| CAS Number | 79030-59-4 |
|---|---|
| SMILES | CC(C)NCC(COC1=C(C=C(C=C1)Br)C(C)O)O |
Product Overview
5-Bromo-2-(2-hydroxy-3-((1-methylethyl)amino)propoxy)-alpha-methylbenzenemethanol (CAS 79030-59-4), with molecular formula C14H22BrNO3 and molecular weight 331.08 g/mol. IUPAC: 1-[4-bromo-2-(1-hydroxyethyl)phenoxy]-3-(propan-2-ylamino)propan-2-ol.
Chemical Property Profile of 5-Bromo-2-(2-hydroxy-3-((1-methylethyl)amino)propoxy)-alpha-methylbenzenemethanol
Property Insights of 5-Bromo-2-(2-hydroxy-3-((1-methylethyl)amino)propoxy)-alpha-methylbenzenemethanol
The XLogP value of 2.2401 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Bromo-2-(2-hydroxy-3-((1-methylethyl)amino)propoxy)-alpha-methylbenzenemethanol. The TPSA of 61.72 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-Bromo-2-(2-hydroxy-3-((1-methylethyl)amino)propoxy)-alpha-methylbenzenemethanol. Following Lipinski's Rule of Five, 5-Bromo-2-(2-hydroxy-3-((1-methylethyl)amino)propoxy)-alpha-methylbenzenemethanol has 3 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 5-Bromo-2-(2-hydroxy-3-((1-methylethyl)amino)propoxy)-alpha-methylbenzenemethanol?
The CAS number of 5-Bromo-2-(2-hydroxy-3-((1-methylethyl)amino)propoxy)-alpha-methylbenzenemethanol is 79030-59-4.
What is the molecular formula of 5-Bromo-2-(2-hydroxy-3-((1-methylethyl)amino)propoxy)-alpha-methylbenzenemethanol?
The molecular formula of 5-Bromo-2-(2-hydroxy-3-((1-methylethyl)amino)propoxy)-alpha-methylbenzenemethanol is C14H22BrNO3.
What is the molecular weight of 5-Bromo-2-(2-hydroxy-3-((1-methylethyl)amino)propoxy)-alpha-methylbenzenemethanol?
The molecular weight of 5-Bromo-2-(2-hydroxy-3-((1-methylethyl)amino)propoxy)-alpha-methylbenzenemethanol is 331.08 g/mol.
Where can I buy 5-Bromo-2-(2-hydroxy-3-((1-methylethyl)amino)propoxy)-alpha-methylbenzenemethanol?
You can request a quote for 5-Bromo-2-(2-hydroxy-3-((1-methylethyl)amino)propoxy)-alpha-methylbenzenemethanol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Bromo-2-(2-hydroxy-3-((1-methylethyl)amino)propoxy)-alpha-methylbenzenemethanol?
Yes, KEHONG BIO provides custom synthesis services for 5-Bromo-2-(2-hydroxy-3-((1-methylethyl)amino)propoxy)-alpha-methylbenzenemethanol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.