(2E)-2-(3-aminoisoindol-1-ylidene)-2-cyano-N-(2,3-dihydro-1,4-benzodioxin-6-yl)acetamide
TL;DR: (2E)-2-(3-aminoisoindol-1-ylidene)-2-cyano-N-(2,3-dihydro-1,4-benzodioxin-6-yl)acetamide (CAS 790272-33-2) is a chemical compound with molecular formula C19H14N4O3 and molecular weight 346.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2E)-2-(3-aminoisoindol-1-ylidene)-2-cyano-N-(2,3-dihydro-1,4-benzodioxin-6-yl)acetamide
Also Known As: (2E)-2-(3-aminoisoindol-1-ylidene)-2-cyano-N-(2,3-dihydro-1,4-benzodioxin-6-yl)acetamide, 2-(3-amino-1H-isoindol-1-ylidene)-2-cyano-N-(2,3-dihydro-1,4-benzodioxin-6-yl)acetamide
| Molecular Formula | C19H14N4O3 |
|---|---|
| Molecular Weight | 346.11 g/mol |
| LogP | 2.05008 |
| Topological Polar Surface Area | 109.73 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 346.1066 |
| Heavy Atoms | 26 |
| Complexity | 1017.6846 |
Chemical Identifiers
| CAS Number | 790272-33-2 |
|---|---|
| SMILES | C1COC2=C(O1)C=CC(=C2)NC(=O)/C(=C/3\C4=CC=CC=C4C(=N3)N)/C#N |
Product Overview
(2E)-2-(3-aminoisoindol-1-ylidene)-2-cyano-N-(2,3-dihydro-1,4-benzodioxin-6-yl)acetamide (CAS 790272-33-2), with molecular formula C19H14N4O3 and molecular weight 346.11 g/mol. IUPAC: (2E)-2-(3-aminoisoindol-1-ylidene)-2-cyano-N-(2,3-dihydro-1,4-benzodioxin-6-yl)acetamide.
Chemical Property Profile of (2E)-2-(3-aminoisoindol-1-ylidene)-2-cyano-N-(2,3-dihydro-1,4-benzodioxin-6-yl)acetamide
Property Insights of (2E)-2-(3-aminoisoindol-1-ylidene)-2-cyano-N-(2,3-dihydro-1,4-benzodioxin-6-yl)acetamide
The XLogP value of 2.05008 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (2E)-2-(3-aminoisoindol-1-ylidene)-2-cyano-N-(2,3-dihydro-1,4-benzodioxin-6-yl)acetamide. The TPSA of 109.73 Ų falls within the moderate polarity range, balancing permeability and solubility for (2E)-2-(3-aminoisoindol-1-ylidene)-2-cyano-N-(2,3-dihydro-1,4-benzodioxin-6-yl)acetamide. Following Lipinski's Rule of Five, (2E)-2-(3-aminoisoindol-1-ylidene)-2-cyano-N-(2,3-dihydro-1,4-benzodioxin-6-yl)acetamide has 2 hydrogen bond donor(s) and 6 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 (2E)-2-(3-aminoisoindol-1-ylidene)-2-cyano-N-(2,3-dihydro-1,4-benzodioxin-6-yl)acetamide?
The CAS number of (2E)-2-(3-aminoisoindol-1-ylidene)-2-cyano-N-(2,3-dihydro-1,4-benzodioxin-6-yl)acetamide is 790272-33-2.
What is the molecular formula of (2E)-2-(3-aminoisoindol-1-ylidene)-2-cyano-N-(2,3-dihydro-1,4-benzodioxin-6-yl)acetamide?
The molecular formula of (2E)-2-(3-aminoisoindol-1-ylidene)-2-cyano-N-(2,3-dihydro-1,4-benzodioxin-6-yl)acetamide is C19H14N4O3.
What is the molecular weight of (2E)-2-(3-aminoisoindol-1-ylidene)-2-cyano-N-(2,3-dihydro-1,4-benzodioxin-6-yl)acetamide?
The molecular weight of (2E)-2-(3-aminoisoindol-1-ylidene)-2-cyano-N-(2,3-dihydro-1,4-benzodioxin-6-yl)acetamide is 346.11 g/mol.
Where can I buy (2E)-2-(3-aminoisoindol-1-ylidene)-2-cyano-N-(2,3-dihydro-1,4-benzodioxin-6-yl)acetamide?
You can request a quote for (2E)-2-(3-aminoisoindol-1-ylidene)-2-cyano-N-(2,3-dihydro-1,4-benzodioxin-6-yl)acetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2E)-2-(3-aminoisoindol-1-ylidene)-2-cyano-N-(2,3-dihydro-1,4-benzodioxin-6-yl)acetamide?
Yes, KEHONG BIO provides custom synthesis services for (2E)-2-(3-aminoisoindol-1-ylidene)-2-cyano-N-(2,3-dihydro-1,4-benzodioxin-6-yl)acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.