![Diethyl 2-[[4-(3-phenoxypropoxy)anilino]methylidene]propanedioate structure](/static/products/3595/35957-48-3.webp)
Diethyl 2-[[4-(3-phenoxypropoxy)anilino]methylidene]propanedioate
TL;DR: Diethyl 2-[[4-(3-phenoxypropoxy)anilino]methylidene]propanedioate (CAS 35957-48-3) is a chemical compound with molecular formula C23H27NO6 and molecular weight 413.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
diethyl 2-[[4-(3-phenoxypropoxy)anilino]methylidene]propanedioate
Also Known As: diethyl 2-[[4-(3-phenoxypropoxy)anilino]methylidene]propanedioate, Diethyl {[4-(3-phenoxypropoxy)anilino]methylidene}propanedioate
| Molecular Formula | C23H27NO6 |
|---|---|
| Molecular Weight | 413.18 g/mol |
| LogP | 5.2 |
| Topological Polar Surface Area | 83.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 14 |
| Exact Mass | 413.18384 |
| Heavy Atoms | 30 |
| Complexity | 516.0 |
Chemical Identifiers
| CAS Number | 35957-48-3 |
|---|---|
| SMILES | CCOC(=O)C(=CNC1=CC=C(C=C1)OCCCOC2=CC=CC=C2)C(=O)OCC |
| InChIKey | XEEZMBHMRCNBKQ-UHFFFAOYSA-N |
Product Overview
Diethyl 2-[[4-(3-phenoxypropoxy)anilino]methylidene]propanedioate (CAS 35957-48-3), with molecular formula C23H27NO6 and molecular weight 413.18 g/mol. IUPAC: diethyl 2-[[4-(3-phenoxypropoxy)anilino]methylidene]propanedioate.
Chemical Property Profile of Diethyl 2-[[4-(3-phenoxypropoxy)anilino]methylidene]propanedioate
Property Insights of Diethyl 2-[[4-(3-phenoxypropoxy)anilino]methylidene]propanedioate
The XLogP value of 5.2 indicates that Diethyl 2-[[4-(3-phenoxypropoxy)anilino]methylidene]propanedioate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 83.1 Ų falls within the moderate polarity range, balancing permeability and solubility for Diethyl 2-[[4-(3-phenoxypropoxy)anilino]methylidene]propanedioate. Following Lipinski's Rule of Five, Diethyl 2-[[4-(3-phenoxypropoxy)anilino]methylidene]propanedioate has 1 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Diethyl 2-[[4-(3-phenoxypropoxy)anilino]methylidene]propanedioate?
The CAS number of Diethyl 2-[[4-(3-phenoxypropoxy)anilino]methylidene]propanedioate is 35957-48-3.
What is the molecular formula of Diethyl 2-[[4-(3-phenoxypropoxy)anilino]methylidene]propanedioate?
The molecular formula of Diethyl 2-[[4-(3-phenoxypropoxy)anilino]methylidene]propanedioate is C23H27NO6.
What is the molecular weight of Diethyl 2-[[4-(3-phenoxypropoxy)anilino]methylidene]propanedioate?
The molecular weight of Diethyl 2-[[4-(3-phenoxypropoxy)anilino]methylidene]propanedioate is 413.18 g/mol.
Where can I buy Diethyl 2-[[4-(3-phenoxypropoxy)anilino]methylidene]propanedioate?
You can request a quote for Diethyl 2-[[4-(3-phenoxypropoxy)anilino]methylidene]propanedioate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Diethyl 2-[[4-(3-phenoxypropoxy)anilino]methylidene]propanedioate?
Yes, KEHONG BIO provides custom synthesis services for Diethyl 2-[[4-(3-phenoxypropoxy)anilino]methylidene]propanedioate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.