Methyl 3-(2-(2-hydroxy-3-(isopropylamino)propoxy)phenyl)propanoate
TL;DR: Methyl 3-(2-(2-hydroxy-3-(isopropylamino)propoxy)phenyl)propanoate (CAS 83281-63-4) is a chemical compound with molecular formula C16H25NO4 and molecular weight 295.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 3-[2-[2-hydroxy-3-(propan-2-ylamino)propoxy]phenyl]propanoate
Also Known As: Esmolol Impurity 56, Esmolol Impurity 72, methyl 3-(2-(2-hydroxy-3-(isopropylamino)propoxy)phenyl)propanoate, Methyl 3-[2-[2-hydroxy-3-(propan-2-ylamino)propoxy]phenyl]propanoate
| Molecular Formula | C16H25NO4 |
|---|---|
| Molecular Weight | 295.18 g/mol |
| LogP | 1.5299 |
| Topological Polar Surface Area | 67.79 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 9 |
| Exact Mass | 295.17834 |
| Heavy Atoms | 21 |
| Complexity | 434.04007 |
Chemical Identifiers
| CAS Number | 83281-63-4 |
|---|---|
| SMILES | CC(C)NCC(COC1=CC=CC=C1CCC(=O)OC)O |
Product Overview
Methyl 3-(2-(2-hydroxy-3-(isopropylamino)propoxy)phenyl)propanoate (CAS 83281-63-4), with molecular formula C16H25NO4 and molecular weight 295.18 g/mol. IUPAC: methyl 3-[2-[2-hydroxy-3-(propan-2-ylamino)propoxy]phenyl]propanoate.
Chemical Property Profile of Methyl 3-(2-(2-hydroxy-3-(isopropylamino)propoxy)phenyl)propanoate
Property Insights of Methyl 3-(2-(2-hydroxy-3-(isopropylamino)propoxy)phenyl)propanoate
The XLogP value of 1.5299 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 3-(2-(2-hydroxy-3-(isopropylamino)propoxy)phenyl)propanoate. The TPSA of 67.79 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 3-(2-(2-hydroxy-3-(isopropylamino)propoxy)phenyl)propanoate. Following Lipinski's Rule of Five, Methyl 3-(2-(2-hydroxy-3-(isopropylamino)propoxy)phenyl)propanoate has 2 hydrogen bond donor(s) and 5 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 Methyl 3-(2-(2-hydroxy-3-(isopropylamino)propoxy)phenyl)propanoate?
The CAS number of Methyl 3-(2-(2-hydroxy-3-(isopropylamino)propoxy)phenyl)propanoate is 83281-63-4.
What is the molecular formula of Methyl 3-(2-(2-hydroxy-3-(isopropylamino)propoxy)phenyl)propanoate?
The molecular formula of Methyl 3-(2-(2-hydroxy-3-(isopropylamino)propoxy)phenyl)propanoate is C16H25NO4.
What is the molecular weight of Methyl 3-(2-(2-hydroxy-3-(isopropylamino)propoxy)phenyl)propanoate?
The molecular weight of Methyl 3-(2-(2-hydroxy-3-(isopropylamino)propoxy)phenyl)propanoate is 295.18 g/mol.
Where can I buy Methyl 3-(2-(2-hydroxy-3-(isopropylamino)propoxy)phenyl)propanoate?
You can request a quote for Methyl 3-(2-(2-hydroxy-3-(isopropylamino)propoxy)phenyl)propanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 3-(2-(2-hydroxy-3-(isopropylamino)propoxy)phenyl)propanoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 3-(2-(2-hydroxy-3-(isopropylamino)propoxy)phenyl)propanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.