![Diethyl 2-[(2,3-dihydro-1,4-benzodioxin-6-ylamino)methylidene]propanedioate structure](/static/products/2379/23796-63-6.webp)
Diethyl 2-[(2,3-dihydro-1,4-benzodioxin-6-ylamino)methylidene]propanedioate
TL;DR: Diethyl 2-[(2,3-dihydro-1,4-benzodioxin-6-ylamino)methylidene]propanedioate (CAS 23796-63-6) is a chemical compound with molecular formula C16H19NO6 and molecular weight 321.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
diethyl 2-[(2,3-dihydro-1,4-benzodioxin-6-ylamino)methylidene]propanedioate
Also Known As: BIM-0044882.P001, diethyl 2-[(2,3-dihydro-1,4-benzodioxin-6-ylamino)methylidene]propanedioate, diethyl 2-(((2,3-dihydrobenzo[b][1,4]dioxin-6-yl)amino)methylene)malonate, diethyl [(2,3-dihydro-1,4-benzodioxin-6-ylamino)methylidene]propanedioate, 1,3-DIETHYL 2-{[(2,3-DIHYDRO-1,4-BENZODIOXIN-6-YL)AMINO]METHYLIDENE}PROPANEDIOATE
| Molecular Formula | C16H19NO6 |
|---|---|
| Molecular Weight | 321.12 g/mol |
| LogP | 1.8798 |
| Topological Polar Surface Area | 83.09 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 321.12125 |
| Heavy Atoms | 23 |
| Complexity | 590.5881 |
Chemical Identifiers
| CAS Number | 23796-63-6 |
|---|---|
| SMILES | CCOC(=O)C(=CNC1=CC2=C(C=C1)OCCO2)C(=O)OCC |
Product Overview
Diethyl 2-[(2,3-dihydro-1,4-benzodioxin-6-ylamino)methylidene]propanedioate (CAS 23796-63-6), with molecular formula C16H19NO6 and molecular weight 321.12 g/mol. IUPAC: diethyl 2-[(2,3-dihydro-1,4-benzodioxin-6-ylamino)methylidene]propanedioate.
Chemical Property Profile of Diethyl 2-[(2,3-dihydro-1,4-benzodioxin-6-ylamino)methylidene]propanedioate
Property Insights of Diethyl 2-[(2,3-dihydro-1,4-benzodioxin-6-ylamino)methylidene]propanedioate
The XLogP value of 1.8798 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Diethyl 2-[(2,3-dihydro-1,4-benzodioxin-6-ylamino)methylidene]propanedioate. The TPSA of 83.09 Ų falls within the moderate polarity range, balancing permeability and solubility for Diethyl 2-[(2,3-dihydro-1,4-benzodioxin-6-ylamino)methylidene]propanedioate. Following Lipinski's Rule of Five, Diethyl 2-[(2,3-dihydro-1,4-benzodioxin-6-ylamino)methylidene]propanedioate has 1 hydrogen bond donor(s) and 7 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 2-[(2,3-dihydro-1,4-benzodioxin-6-ylamino)methylidene]propanedioate?
The CAS number of Diethyl 2-[(2,3-dihydro-1,4-benzodioxin-6-ylamino)methylidene]propanedioate is 23796-63-6.
What is the molecular formula of Diethyl 2-[(2,3-dihydro-1,4-benzodioxin-6-ylamino)methylidene]propanedioate?
The molecular formula of Diethyl 2-[(2,3-dihydro-1,4-benzodioxin-6-ylamino)methylidene]propanedioate is C16H19NO6.
What is the molecular weight of Diethyl 2-[(2,3-dihydro-1,4-benzodioxin-6-ylamino)methylidene]propanedioate?
The molecular weight of Diethyl 2-[(2,3-dihydro-1,4-benzodioxin-6-ylamino)methylidene]propanedioate is 321.12 g/mol.
Where can I buy Diethyl 2-[(2,3-dihydro-1,4-benzodioxin-6-ylamino)methylidene]propanedioate?
You can request a quote for Diethyl 2-[(2,3-dihydro-1,4-benzodioxin-6-ylamino)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-[(2,3-dihydro-1,4-benzodioxin-6-ylamino)methylidene]propanedioate?
Yes, KEHONG BIO provides custom synthesis services for Diethyl 2-[(2,3-dihydro-1,4-benzodioxin-6-ylamino)methylidene]propanedioate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.