3-{[(5-Bromo-2-methoxyphenyl)methyl]amino}propan-1-ol
TL;DR: 3-{[(5-Bromo-2-methoxyphenyl)methyl]amino}propan-1-ol (CAS 861410-69-7) is a chemical compound with molecular formula C11H16BrNO2 and molecular weight 273.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[(5-bromo-2-methoxyphenyl)methylamino]propan-1-ol
Also Known As: 3-{[(5-bromo-2-methoxyphenyl)methyl]amino}propan-1-ol, 3-((5-Bromo-2-methoxybenzyl)amino)propan-1-ol, 3-[(5-bromo-2-methoxy-phenyl)methylamino]propan-1-ol, 3-[(5-bromo-2-methoxyphenyl)methylamino]propan-1-ol, 1-Propanol, 3-[[(5-bromo-2-methoxyphenyl)methyl]amino]-
| Molecular Formula | C11H16BrNO2 |
|---|---|
| Molecular Weight | 273.04 g/mol |
| LogP | 1.9297 |
| Topological Polar Surface Area | 41.49 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 273.03644 |
| Heavy Atoms | 15 |
| Complexity | 304.63943 |
Chemical Identifiers
| CAS Number | 861410-69-7 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)Br)CNCCCO |
Product Overview
3-{[(5-Bromo-2-methoxyphenyl)methyl]amino}propan-1-ol (CAS 861410-69-7), with molecular formula C11H16BrNO2 and molecular weight 273.04 g/mol. IUPAC: 3-[(5-bromo-2-methoxyphenyl)methylamino]propan-1-ol.
Chemical Property Profile of 3-{[(5-Bromo-2-methoxyphenyl)methyl]amino}propan-1-ol
Property Insights of 3-{[(5-Bromo-2-methoxyphenyl)methyl]amino}propan-1-ol
The XLogP value of 1.9297 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-{[(5-Bromo-2-methoxyphenyl)methyl]amino}propan-1-ol. With a topological polar surface area (TPSA) of 41.49 Ų, 3-{[(5-Bromo-2-methoxyphenyl)methyl]amino}propan-1-ol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-{[(5-Bromo-2-methoxyphenyl)methyl]amino}propan-1-ol has 2 hydrogen bond donor(s) and 3 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 3-{[(5-Bromo-2-methoxyphenyl)methyl]amino}propan-1-ol?
The CAS number of 3-{[(5-Bromo-2-methoxyphenyl)methyl]amino}propan-1-ol is 861410-69-7.
What is the molecular formula of 3-{[(5-Bromo-2-methoxyphenyl)methyl]amino}propan-1-ol?
The molecular formula of 3-{[(5-Bromo-2-methoxyphenyl)methyl]amino}propan-1-ol is C11H16BrNO2.
What is the molecular weight of 3-{[(5-Bromo-2-methoxyphenyl)methyl]amino}propan-1-ol?
The molecular weight of 3-{[(5-Bromo-2-methoxyphenyl)methyl]amino}propan-1-ol is 273.04 g/mol.
Where can I buy 3-{[(5-Bromo-2-methoxyphenyl)methyl]amino}propan-1-ol?
You can request a quote for 3-{[(5-Bromo-2-methoxyphenyl)methyl]amino}propan-1-ol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-{[(5-Bromo-2-methoxyphenyl)methyl]amino}propan-1-ol?
Yes, KEHONG BIO provides custom synthesis services for 3-{[(5-Bromo-2-methoxyphenyl)methyl]amino}propan-1-ol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.