![Diethyl formamido[(1H-indol-3-yl)methyl]propanedioate structure](/static/products/6493/6493-53-4.webp)
Diethyl formamido[(1H-indol-3-yl)methyl]propanedioate
TL;DR: Diethyl formamido[(1H-indol-3-yl)methyl]propanedioate (CAS 6493-53-4) is a chemical compound with molecular formula C17H20N2O5 and molecular weight 332.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
diethyl 2-formamido-2-(1H-indol-3-ylmethyl)propanedioate
Also Known As: Diethyl formamido[(1H-indol-3-yl)methyl]propanedioate, diethyl(formylamino)(1h-indol-3-ylmethyl)propanedioate, diethyl 2-formamido-2-(1H-indol-3-ylmethyl)propanedioate, ethyl 2-formamido-3-(3-indolyl)-2-carbethoxypropionate, 2-Formamido-3-(3-indolyl)-2-carbethoxypropionic acid ethyl ester
| Molecular Formula | C17H20N2O5 |
|---|---|
| Molecular Weight | 332.14 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 97.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 9 |
| Exact Mass | 332.1372 |
| Heavy Atoms | 24 |
| Complexity | 450.0 |
Chemical Identifiers
| CAS Number | 6493-53-4 |
|---|---|
| SMILES | CCOC(=O)C(CC1=CNC2=CC=CC=C21)(C(=O)OCC)NC=O |
| InChIKey | ZAIGSUKBOXJYBT-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Diethyl formamido[(1H-indol-3-yl)methyl]propanedioate (CAS 6493-53-4), with molecular formula C17H20N2O5 and molecular weight 332.14 g/mol. IUPAC: diethyl 2-formamido-2-(1H-indol-3-ylmethyl)propanedioate.
Chemical Property Profile of Diethyl formamido[(1H-indol-3-yl)methyl]propanedioate
Property Insights of Diethyl formamido[(1H-indol-3-yl)methyl]propanedioate
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Diethyl formamido[(1H-indol-3-yl)methyl]propanedioate. The TPSA of 97.5 Ų falls within the moderate polarity range, balancing permeability and solubility for Diethyl formamido[(1H-indol-3-yl)methyl]propanedioate. Following Lipinski's Rule of Five, Diethyl formamido[(1H-indol-3-yl)methyl]propanedioate has 2 hydrogen bond donor(s) and 5 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 formamido[(1H-indol-3-yl)methyl]propanedioate?
The CAS number of Diethyl formamido[(1H-indol-3-yl)methyl]propanedioate is 6493-53-4.
What is the molecular formula of Diethyl formamido[(1H-indol-3-yl)methyl]propanedioate?
The molecular formula of Diethyl formamido[(1H-indol-3-yl)methyl]propanedioate is C17H20N2O5.
What is the molecular weight of Diethyl formamido[(1H-indol-3-yl)methyl]propanedioate?
The molecular weight of Diethyl formamido[(1H-indol-3-yl)methyl]propanedioate is 332.14 g/mol.
Where can I buy Diethyl formamido[(1H-indol-3-yl)methyl]propanedioate?
You can request a quote for Diethyl formamido[(1H-indol-3-yl)methyl]propanedioate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Diethyl formamido[(1H-indol-3-yl)methyl]propanedioate?
Yes, KEHONG BIO provides custom synthesis services for Diethyl formamido[(1H-indol-3-yl)methyl]propanedioate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.