![N-[3-(4-Benzylphenoxy)propyl]-N-Methyl-Beta-Alanine structure](/static/products/179/179022-08-3.png)
N-[3-(4-Benzylphenoxy)propyl]-N-Methyl-Beta-Alanine
TL;DR: N-[3-(4-Benzylphenoxy)propyl]-N-Methyl-Beta-Alanine (CAS 179022-08-3) is a chemical compound with molecular formula C20H25NO3 and molecular weight 327.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[3-(4-benzylphenoxy)propyl-methylamino]propanoic acid
Also Known As: SC 57461A, SC-57461A, N-[3-(4-Benzylphenoxy)propyl]-N-Methyl-Beta-Alanine, EC-000.2445, b-Alanine,N-methyl-N-[3-[4-(phenylmethyl)phenoxy]propyl]-
| Molecular Formula | C20H25NO3 |
|---|---|
| Molecular Weight | 327.18 g/mol |
| LogP | 3.4528 |
| Topological Polar Surface Area | 49.77 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 10 |
| Exact Mass | 327.18344 |
| Heavy Atoms | 24 |
| Complexity | 610.5409 |
Chemical Identifiers
| CAS Number | 179022-08-3 |
|---|---|
| SMILES | CN(CCCOC1=CC=C(C=C1)CC2=CC=CC=C2)CCC(=O)O |
Product Overview
N-[3-(4-Benzylphenoxy)propyl]-N-Methyl-Beta-Alanine (CAS 179022-08-3), with molecular formula C20H25NO3 and molecular weight 327.18 g/mol. IUPAC: 3-[3-(4-benzylphenoxy)propyl-methylamino]propanoic acid.
Chemical Property Profile of N-[3-(4-Benzylphenoxy)propyl]-N-Methyl-Beta-Alanine
Property Insights of N-[3-(4-Benzylphenoxy)propyl]-N-Methyl-Beta-Alanine
The XLogP value of 3.4528 indicates that N-[3-(4-Benzylphenoxy)propyl]-N-Methyl-Beta-Alanine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.77 Ų, N-[3-(4-Benzylphenoxy)propyl]-N-Methyl-Beta-Alanine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-[3-(4-Benzylphenoxy)propyl]-N-Methyl-Beta-Alanine has 1 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 N-[3-(4-Benzylphenoxy)propyl]-N-Methyl-Beta-Alanine?
The CAS number of N-[3-(4-Benzylphenoxy)propyl]-N-Methyl-Beta-Alanine is 179022-08-3.
What is the molecular formula of N-[3-(4-Benzylphenoxy)propyl]-N-Methyl-Beta-Alanine?
The molecular formula of N-[3-(4-Benzylphenoxy)propyl]-N-Methyl-Beta-Alanine is C20H25NO3.
What is the molecular weight of N-[3-(4-Benzylphenoxy)propyl]-N-Methyl-Beta-Alanine?
The molecular weight of N-[3-(4-Benzylphenoxy)propyl]-N-Methyl-Beta-Alanine is 327.18 g/mol.
Where can I buy N-[3-(4-Benzylphenoxy)propyl]-N-Methyl-Beta-Alanine?
You can request a quote for N-[3-(4-Benzylphenoxy)propyl]-N-Methyl-Beta-Alanine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[3-(4-Benzylphenoxy)propyl]-N-Methyl-Beta-Alanine?
Yes, KEHONG BIO provides custom synthesis services for N-[3-(4-Benzylphenoxy)propyl]-N-Methyl-Beta-Alanine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.