![diethyl [(1-benzyl-1H-indol-3-yl)methylidene]propanedioate structure](/static/products/429/42924-86-7.png)
diethyl [(1-benzyl-1H-indol-3-yl)methylidene]propanedioate
TL;DR: diethyl [(1-benzyl-1H-indol-3-yl)methylidene]propanedioate (CAS 42924-86-7) is a chemical compound with molecular formula C23H23NO4 and molecular weight 377.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
diethyl 2-[(1-benzylindol-3-yl)methylidene]propanedioate
Also Known As: diethyl [(1-benzyl-1H-indol-3-yl)methylene]malonate, diethyl 2-((1-benzyl-1H-indol-3-yl)methylene)malonate, diethyl 2-[(1-benzylindol-3-yl)methylidene]propanedioate, diethyl [(1-benzyl-1H-indol-3-yl)methylidene]propanedioate
| Molecular Formula | C23H23NO4 |
|---|---|
| Molecular Weight | 377.16 g/mol |
| LogP | 4.1992 |
| Topological Polar Surface Area | 57.53 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 377.16272 |
| Heavy Atoms | 28 |
| Complexity | 981.874 |
Chemical Identifiers
| CAS Number | 42924-86-7 |
|---|---|
| SMILES | CCOC(=O)C(=CC1=CN(C2=CC=CC=C21)CC3=CC=CC=C3)C(=O)OCC |
Product Overview
diethyl [(1-benzyl-1H-indol-3-yl)methylidene]propanedioate (CAS 42924-86-7), with molecular formula C23H23NO4 and molecular weight 377.16 g/mol. IUPAC: diethyl 2-[(1-benzylindol-3-yl)methylidene]propanedioate.
Chemical Property Profile of diethyl [(1-benzyl-1H-indol-3-yl)methylidene]propanedioate
Property Insights of diethyl [(1-benzyl-1H-indol-3-yl)methylidene]propanedioate
The XLogP value of 4.1992 indicates that diethyl [(1-benzyl-1H-indol-3-yl)methylidene]propanedioate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 57.53 Ų, diethyl [(1-benzyl-1H-indol-3-yl)methylidene]propanedioate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, diethyl [(1-benzyl-1H-indol-3-yl)methylidene]propanedioate has 0 hydrogen bond donor(s) and 4 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 diethyl [(1-benzyl-1H-indol-3-yl)methylidene]propanedioate?
The CAS number of diethyl [(1-benzyl-1H-indol-3-yl)methylidene]propanedioate is 42924-86-7.
What is the molecular formula of diethyl [(1-benzyl-1H-indol-3-yl)methylidene]propanedioate?
The molecular formula of diethyl [(1-benzyl-1H-indol-3-yl)methylidene]propanedioate is C23H23NO4.
What is the molecular weight of diethyl [(1-benzyl-1H-indol-3-yl)methylidene]propanedioate?
The molecular weight of diethyl [(1-benzyl-1H-indol-3-yl)methylidene]propanedioate is 377.16 g/mol.
Where can I buy diethyl [(1-benzyl-1H-indol-3-yl)methylidene]propanedioate?
You can request a quote for diethyl [(1-benzyl-1H-indol-3-yl)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 [(1-benzyl-1H-indol-3-yl)methylidene]propanedioate?
Yes, KEHONG BIO provides custom synthesis services for diethyl [(1-benzyl-1H-indol-3-yl)methylidene]propanedioate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.