(5-nitro-2-oxo-1,2-dihydro-3H-indol-3-ylidene)propanedinitrile
TL;DR: (5-nitro-2-oxo-1,2-dihydro-3H-indol-3-ylidene)propanedinitrile (CAS 124406-00-4) is a chemical compound with molecular formula C11H4N4O3 and molecular weight 240.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(5-nitro-2-oxo-1H-indol-3-ylidene)propanedinitrile
Also Known As: Tyrphostin deriv. 20, (5-nitro-2-oxo-1,2-dihydro-3H-indol-3-ylidene)propanedinitrile, 2-(5-nitro-2-oxo-1H-indol-3-ylidene)propanedinitrile, 2-(5-nitro-2-oxo-2,3-dihydro-1H-indol-3-ylidene)propanedinitrile, [(2,3-Dihydro-5-nitro-2-oxo-1H-indol)-3-ylidene]malononitrile
| Molecular Formula | C11H4N4O3 |
|---|---|
| Molecular Weight | 240.03 g/mol |
| LogP | 1.34766 |
| Topological Polar Surface Area | 119.82 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 240.02834 |
| Heavy Atoms | 18 |
| Complexity | 675.2204 |
Chemical Identifiers
| CAS Number | 124406-00-4 |
|---|---|
| SMILES | C1=CC2=C(C=C1[N+](=O)[O-])C(=C(C#N)C#N)C(=O)N2 |
Product Overview
(5-nitro-2-oxo-1,2-dihydro-3H-indol-3-ylidene)propanedinitrile (CAS 124406-00-4), with molecular formula C11H4N4O3 and molecular weight 240.03 g/mol. IUPAC: 2-(5-nitro-2-oxo-1H-indol-3-ylidene)propanedinitrile.
Chemical Property Profile of (5-nitro-2-oxo-1,2-dihydro-3H-indol-3-ylidene)propanedinitrile
Property Insights of (5-nitro-2-oxo-1,2-dihydro-3H-indol-3-ylidene)propanedinitrile
The XLogP value of 1.34766 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (5-nitro-2-oxo-1,2-dihydro-3H-indol-3-ylidene)propanedinitrile. The TPSA of 119.82 Ų falls within the moderate polarity range, balancing permeability and solubility for (5-nitro-2-oxo-1,2-dihydro-3H-indol-3-ylidene)propanedinitrile. Following Lipinski's Rule of Five, (5-nitro-2-oxo-1,2-dihydro-3H-indol-3-ylidene)propanedinitrile has 1 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 (5-nitro-2-oxo-1,2-dihydro-3H-indol-3-ylidene)propanedinitrile?
The CAS number of (5-nitro-2-oxo-1,2-dihydro-3H-indol-3-ylidene)propanedinitrile is 124406-00-4.
What is the molecular formula of (5-nitro-2-oxo-1,2-dihydro-3H-indol-3-ylidene)propanedinitrile?
The molecular formula of (5-nitro-2-oxo-1,2-dihydro-3H-indol-3-ylidene)propanedinitrile is C11H4N4O3.
What is the molecular weight of (5-nitro-2-oxo-1,2-dihydro-3H-indol-3-ylidene)propanedinitrile?
The molecular weight of (5-nitro-2-oxo-1,2-dihydro-3H-indol-3-ylidene)propanedinitrile is 240.03 g/mol.
Where can I buy (5-nitro-2-oxo-1,2-dihydro-3H-indol-3-ylidene)propanedinitrile?
You can request a quote for (5-nitro-2-oxo-1,2-dihydro-3H-indol-3-ylidene)propanedinitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (5-nitro-2-oxo-1,2-dihydro-3H-indol-3-ylidene)propanedinitrile?
Yes, KEHONG BIO provides custom synthesis services for (5-nitro-2-oxo-1,2-dihydro-3H-indol-3-ylidene)propanedinitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.