2-(4-Methoxyphenyl)-4'-(2-(1-pyrrolidinyl)ethoxy)deoxybenzoin
TL;DR: 2-(4-Methoxyphenyl)-4'-(2-(1-pyrrolidinyl)ethoxy)deoxybenzoin (CAS 87198-64-9) is a chemical compound with molecular formula C27H29NO3 and molecular weight 415.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[2-(4-methoxyphenyl)phenyl]-2-[4-(2-pyrrolidin-1-ylethoxy)phenyl]ethanone
Also Known As: 2-Mpped, PEDAP, 2- -4'-(2- deoxybenzoin, 2-(4-Methoxyphenyl)-4'-(2-(1-pyrrolidinyl)ethoxy)deoxybenzoin, 4-(beta(N-Pyrrolidinyl)ethoxy)-4'-alpha,alpha-diphenylacetophenone
| Molecular Formula | C27H29NO3 |
|---|---|
| Molecular Weight | 415.21 g/mol |
| LogP | 5.3 |
| Topological Polar Surface Area | 38.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 9 |
| Exact Mass | 415.21475 |
| Heavy Atoms | 31 |
| Complexity | 531.0 |
Chemical Identifiers
| CAS Number | 87198-64-9 |
|---|---|
| SMILES | COC1=CC=C(C=C1)C2=CC=CC=C2C(=O)CC3=CC=C(C=C3)OCCN4CCCC4 |
| InChIKey | KSOGRLJDZWTTBM-UHFFFAOYSA-N |
Product Overview
2-(4-Methoxyphenyl)-4'-(2-(1-pyrrolidinyl)ethoxy)deoxybenzoin (CAS 87198-64-9), with molecular formula C27H29NO3 and molecular weight 415.21 g/mol. IUPAC: 1-[2-(4-methoxyphenyl)phenyl]-2-[4-(2-pyrrolidin-1-ylethoxy)phenyl]ethanone.
Chemical Property Profile of 2-(4-Methoxyphenyl)-4'-(2-(1-pyrrolidinyl)ethoxy)deoxybenzoin
Property Insights of 2-(4-Methoxyphenyl)-4'-(2-(1-pyrrolidinyl)ethoxy)deoxybenzoin
The XLogP value of 5.3 indicates that 2-(4-Methoxyphenyl)-4'-(2-(1-pyrrolidinyl)ethoxy)deoxybenzoin is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 38.8 Ų, 2-(4-Methoxyphenyl)-4'-(2-(1-pyrrolidinyl)ethoxy)deoxybenzoin exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(4-Methoxyphenyl)-4'-(2-(1-pyrrolidinyl)ethoxy)deoxybenzoin has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-(4-Methoxyphenyl)-4'-(2-(1-pyrrolidinyl)ethoxy)deoxybenzoin?
The CAS number of 2-(4-Methoxyphenyl)-4'-(2-(1-pyrrolidinyl)ethoxy)deoxybenzoin is 87198-64-9.
What is the molecular formula of 2-(4-Methoxyphenyl)-4'-(2-(1-pyrrolidinyl)ethoxy)deoxybenzoin?
The molecular formula of 2-(4-Methoxyphenyl)-4'-(2-(1-pyrrolidinyl)ethoxy)deoxybenzoin is C27H29NO3.
What is the molecular weight of 2-(4-Methoxyphenyl)-4'-(2-(1-pyrrolidinyl)ethoxy)deoxybenzoin?
The molecular weight of 2-(4-Methoxyphenyl)-4'-(2-(1-pyrrolidinyl)ethoxy)deoxybenzoin is 415.21 g/mol.
Where can I buy 2-(4-Methoxyphenyl)-4'-(2-(1-pyrrolidinyl)ethoxy)deoxybenzoin?
You can request a quote for 2-(4-Methoxyphenyl)-4'-(2-(1-pyrrolidinyl)ethoxy)deoxybenzoin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(4-Methoxyphenyl)-4'-(2-(1-pyrrolidinyl)ethoxy)deoxybenzoin?
Yes, KEHONG BIO provides custom synthesis services for 2-(4-Methoxyphenyl)-4'-(2-(1-pyrrolidinyl)ethoxy)deoxybenzoin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.