![Methyl 3-[4-(benzylamino)phenyl]propanoate structure](/static/products/934/93406-97-4.png)
Methyl 3-[4-(benzylamino)phenyl]propanoate
TL;DR: Methyl 3-[4-(benzylamino)phenyl]propanoate (CAS 93406-97-4) is a chemical compound with molecular formula C17H19NO2 and molecular weight 269.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 3-[4-(benzylamino)phenyl]propanoate
Also Known As: methyl 3-[4-(benzylamino)phenyl]propanoate, 3-<4-Benzylamino-phenyl>-propionsaeure-methylester
| Molecular Formula | C17H19NO2 |
|---|---|
| Molecular Weight | 269.14 g/mol |
| LogP | 3.8 |
| Topological Polar Surface Area | 38.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 269.14157 |
| Heavy Atoms | 20 |
| Complexity | 279.0 |
Chemical Identifiers
| CAS Number | 93406-97-4 |
|---|---|
| SMILES | COC(=O)CCC1=CC=C(C=C1)NCC2=CC=CC=C2 |
| InChIKey | BCBKMDQUAKXIFE-UHFFFAOYSA-N |
Product Overview
Methyl 3-[4-(benzylamino)phenyl]propanoate (CAS 93406-97-4), with molecular formula C17H19NO2 and molecular weight 269.14 g/mol. IUPAC: methyl 3-[4-(benzylamino)phenyl]propanoate.
Chemical Property Profile of Methyl 3-[4-(benzylamino)phenyl]propanoate
Property Insights of Methyl 3-[4-(benzylamino)phenyl]propanoate
The XLogP value of 3.8 indicates that Methyl 3-[4-(benzylamino)phenyl]propanoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 38.3 Ų, Methyl 3-[4-(benzylamino)phenyl]propanoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl 3-[4-(benzylamino)phenyl]propanoate 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 Methyl 3-[4-(benzylamino)phenyl]propanoate?
The CAS number of Methyl 3-[4-(benzylamino)phenyl]propanoate is 93406-97-4.
What is the molecular formula of Methyl 3-[4-(benzylamino)phenyl]propanoate?
The molecular formula of Methyl 3-[4-(benzylamino)phenyl]propanoate is C17H19NO2.
What is the molecular weight of Methyl 3-[4-(benzylamino)phenyl]propanoate?
The molecular weight of Methyl 3-[4-(benzylamino)phenyl]propanoate is 269.14 g/mol.
Where can I buy Methyl 3-[4-(benzylamino)phenyl]propanoate?
You can request a quote for Methyl 3-[4-(benzylamino)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-[4-(benzylamino)phenyl]propanoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 3-[4-(benzylamino)phenyl]propanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.