2-{[4-(Benzyloxy)-3-bromo-5-ethoxybenzyl]amino}ethanol
TL;DR: 2-{[4-(Benzyloxy)-3-bromo-5-ethoxybenzyl]amino}ethanol (CAS 774192-24-4) is a chemical compound with molecular formula C18H22BrNO3 and molecular weight 379.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(3-bromo-5-ethoxy-4-phenylmethoxyphenyl)methylamino]ethanol
Also Known As: 2-{[4-(benzyloxy)-3-bromo-5-ethoxybenzyl]amino}ethanol, AP-970/41681521, 2-(4-Benzyloxy-3-bromo-5-ethoxy-benzylamino)-ethanol, 2-[(3-bromo-5-ethoxy-4-phenylmethoxyphenyl)methylamino]ethanol, 2-({[4-(benzyloxy)-3-bromo-5-ethoxyphenyl]methyl}amino)ethan-1-ol
| Molecular Formula | C18H22BrNO3 |
|---|---|
| Molecular Weight | 379.08 g/mol |
| LogP | 3.5087 |
| Topological Polar Surface Area | 50.72 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 9 |
| Exact Mass | 379.0783 |
| Heavy Atoms | 23 |
| Complexity | 604.71576 |
Chemical Identifiers
| CAS Number | 774192-24-4 |
|---|---|
| SMILES | CCOC1=C(C(=CC(=C1)CNCCO)Br)OCC2=CC=CC=C2 |
Product Overview
2-{[4-(Benzyloxy)-3-bromo-5-ethoxybenzyl]amino}ethanol (CAS 774192-24-4), with molecular formula C18H22BrNO3 and molecular weight 379.08 g/mol. IUPAC: 2-[(3-bromo-5-ethoxy-4-phenylmethoxyphenyl)methylamino]ethanol.
Chemical Property Profile of 2-{[4-(Benzyloxy)-3-bromo-5-ethoxybenzyl]amino}ethanol
Property Insights of 2-{[4-(Benzyloxy)-3-bromo-5-ethoxybenzyl]amino}ethanol
The XLogP value of 3.5087 indicates that 2-{[4-(Benzyloxy)-3-bromo-5-ethoxybenzyl]amino}ethanol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 50.72 Ų, 2-{[4-(Benzyloxy)-3-bromo-5-ethoxybenzyl]amino}ethanol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-{[4-(Benzyloxy)-3-bromo-5-ethoxybenzyl]amino}ethanol has 2 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-(Benzyloxy)-3-bromo-5-ethoxybenzyl]amino}ethanol?
The CAS number of 2-{[4-(Benzyloxy)-3-bromo-5-ethoxybenzyl]amino}ethanol is 774192-24-4.
What is the molecular formula of 2-{[4-(Benzyloxy)-3-bromo-5-ethoxybenzyl]amino}ethanol?
The molecular formula of 2-{[4-(Benzyloxy)-3-bromo-5-ethoxybenzyl]amino}ethanol is C18H22BrNO3.
What is the molecular weight of 2-{[4-(Benzyloxy)-3-bromo-5-ethoxybenzyl]amino}ethanol?
The molecular weight of 2-{[4-(Benzyloxy)-3-bromo-5-ethoxybenzyl]amino}ethanol is 379.08 g/mol.
Where can I buy 2-{[4-(Benzyloxy)-3-bromo-5-ethoxybenzyl]amino}ethanol?
You can request a quote for 2-{[4-(Benzyloxy)-3-bromo-5-ethoxybenzyl]amino}ethanol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-{[4-(Benzyloxy)-3-bromo-5-ethoxybenzyl]amino}ethanol?
Yes, KEHONG BIO provides custom synthesis services for 2-{[4-(Benzyloxy)-3-bromo-5-ethoxybenzyl]amino}ethanol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.