2-(1-(2-morpholinoethyl)-2-oxoindolin-3-ylidene)malononitrile
TL;DR: 2-(1-(2-morpholinoethyl)-2-oxoindolin-3-ylidene)malononitrile (CAS 899409-66-6) is a chemical compound with molecular formula C17H16N4O2 and molecular weight 308.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[1-(2-morpholin-4-ylethyl)-2-oxoindol-3-ylidene]propanedinitrile
Also Known As: 2-(1-(2-morpholinoethyl)-2-oxoindolin-3-ylidene)malononitrile, 2-[1-(2-morpholin-4-ylethyl)-2-oxoindol-3-ylidene]propanedinitrile, 2-[1-(2-morpholin-4-ylethyl)-2-oxo-indol-3-ylidene]propanedinitrile, {1-[2-(morpholin-4-yl)ethyl]-2-oxo-1,2-dihydro-3H-indol-3-ylidene}propanedinitrile, 2-[1-(2-Morpholin-4-yl-ethyl)-2-oxo-1,2-dihydro-indol-3-ylidene]-malononitrile
| Molecular Formula | C17H16N4O2 |
|---|---|
| Molecular Weight | 308.13 g/mol |
| LogP | 1.16616 |
| Topological Polar Surface Area | 80.36 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 308.12732 |
| Heavy Atoms | 23 |
| Complexity | 719.6956 |
Chemical Identifiers
| CAS Number | 899409-66-6 |
|---|---|
| SMILES | C1COCCN1CCN2C3=CC=CC=C3C(=C(C#N)C#N)C2=O |
Product Overview
2-(1-(2-morpholinoethyl)-2-oxoindolin-3-ylidene)malononitrile (CAS 899409-66-6), with molecular formula C17H16N4O2 and molecular weight 308.13 g/mol. IUPAC: 2-[1-(2-morpholin-4-ylethyl)-2-oxoindol-3-ylidene]propanedinitrile.
Chemical Property Profile of 2-(1-(2-morpholinoethyl)-2-oxoindolin-3-ylidene)malononitrile
Property Insights of 2-(1-(2-morpholinoethyl)-2-oxoindolin-3-ylidene)malononitrile
The XLogP value of 1.16616 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(1-(2-morpholinoethyl)-2-oxoindolin-3-ylidene)malononitrile. The TPSA of 80.36 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(1-(2-morpholinoethyl)-2-oxoindolin-3-ylidene)malononitrile. Following Lipinski's Rule of Five, 2-(1-(2-morpholinoethyl)-2-oxoindolin-3-ylidene)malononitrile has 0 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 2-(1-(2-morpholinoethyl)-2-oxoindolin-3-ylidene)malononitrile?
The CAS number of 2-(1-(2-morpholinoethyl)-2-oxoindolin-3-ylidene)malononitrile is 899409-66-6.
What is the molecular formula of 2-(1-(2-morpholinoethyl)-2-oxoindolin-3-ylidene)malononitrile?
The molecular formula of 2-(1-(2-morpholinoethyl)-2-oxoindolin-3-ylidene)malononitrile is C17H16N4O2.
What is the molecular weight of 2-(1-(2-morpholinoethyl)-2-oxoindolin-3-ylidene)malononitrile?
The molecular weight of 2-(1-(2-morpholinoethyl)-2-oxoindolin-3-ylidene)malononitrile is 308.13 g/mol.
Where can I buy 2-(1-(2-morpholinoethyl)-2-oxoindolin-3-ylidene)malononitrile?
You can request a quote for 2-(1-(2-morpholinoethyl)-2-oxoindolin-3-ylidene)malononitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(1-(2-morpholinoethyl)-2-oxoindolin-3-ylidene)malononitrile?
Yes, KEHONG BIO provides custom synthesis services for 2-(1-(2-morpholinoethyl)-2-oxoindolin-3-ylidene)malononitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.