Benzyl 3-(benzylamino)-2-phenylpropanoate
TL;DR: Benzyl 3-(benzylamino)-2-phenylpropanoate (CAS 7512-25-6) is a chemical compound with molecular formula C23H23NO2 and molecular weight 345.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
benzyl 3-(benzylamino)-2-phenylpropanoate
Also Known As: benzyl 3-(benzylamino)-2-phenylpropanoate, Benzeneaceticacid, a-[[(phenylmethyl)amino]methyl]-, phenylmethyl ester, Benzeneaceticacid,a-[[(phenylmethyl)amino]methyl]-,phenylmethyl ester
| Molecular Formula | C23H23NO2 |
|---|---|
| Molecular Weight | 345.17 g/mol |
| LogP | 4.3 |
| Topological Polar Surface Area | 38.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 9 |
| Exact Mass | 345.17288 |
| Heavy Atoms | 26 |
| Complexity | 393.0 |
Chemical Identifiers
| CAS Number | 7512-25-6 |
|---|---|
| SMILES | C1=CC=C(C=C1)CNCC(C2=CC=CC=C2)C(=O)OCC3=CC=CC=C3 |
| InChIKey | IZWFQTWSFRVYBE-UHFFFAOYSA-N |
Product Overview
Benzyl 3-(benzylamino)-2-phenylpropanoate (CAS 7512-25-6), with molecular formula C23H23NO2 and molecular weight 345.17 g/mol. IUPAC: benzyl 3-(benzylamino)-2-phenylpropanoate.
Chemical Property Profile of Benzyl 3-(benzylamino)-2-phenylpropanoate
Property Insights of Benzyl 3-(benzylamino)-2-phenylpropanoate
The XLogP value of 4.3 indicates that Benzyl 3-(benzylamino)-2-phenylpropanoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 38.3 Ų, Benzyl 3-(benzylamino)-2-phenylpropanoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzyl 3-(benzylamino)-2-phenylpropanoate 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 Benzyl 3-(benzylamino)-2-phenylpropanoate?
The CAS number of Benzyl 3-(benzylamino)-2-phenylpropanoate is 7512-25-6.
What is the molecular formula of Benzyl 3-(benzylamino)-2-phenylpropanoate?
The molecular formula of Benzyl 3-(benzylamino)-2-phenylpropanoate is C23H23NO2.
What is the molecular weight of Benzyl 3-(benzylamino)-2-phenylpropanoate?
The molecular weight of Benzyl 3-(benzylamino)-2-phenylpropanoate is 345.17 g/mol.
Where can I buy Benzyl 3-(benzylamino)-2-phenylpropanoate?
You can request a quote for Benzyl 3-(benzylamino)-2-phenylpropanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzyl 3-(benzylamino)-2-phenylpropanoate?
Yes, KEHONG BIO provides custom synthesis services for Benzyl 3-(benzylamino)-2-phenylpropanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.