![2-[1-Methoxy-3-(4-nitroanilino)prop-2-enylidene]propanedinitrile structure](/static/products/3419/341966-92-5.webp)
2-[1-Methoxy-3-(4-nitroanilino)prop-2-enylidene]propanedinitrile
TL;DR: 2-[1-Methoxy-3-(4-nitroanilino)prop-2-enylidene]propanedinitrile (CAS 341966-92-5) is a chemical compound with molecular formula C13H10N4O3 and molecular weight 270.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[1-methoxy-3-(4-nitroanilino)prop-2-enylidene]propanedinitrile
Also Known As: 2-[1-methoxy-3-(4-nitroanilino)-2-propenylidene]malononitrile, 2-[1-methoxy-3-(4-nitroanilino)prop-2-enylidene]propanedinitrile
| Molecular Formula | C13H10N4O3 |
|---|---|
| Molecular Weight | 270.08 g/mol |
| LogP | 2.46806 |
| Topological Polar Surface Area | 111.98 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 270.0753 |
| Heavy Atoms | 20 |
| Complexity | 617.0655 |
Chemical Identifiers
| CAS Number | 341966-92-5 |
|---|---|
| SMILES | COC(=C(C#N)C#N)C=CNC1=CC=C(C=C1)[N+](=O)[O-] |
Product Overview
2-[1-Methoxy-3-(4-nitroanilino)prop-2-enylidene]propanedinitrile (CAS 341966-92-5), with molecular formula C13H10N4O3 and molecular weight 270.08 g/mol. IUPAC: 2-[1-methoxy-3-(4-nitroanilino)prop-2-enylidene]propanedinitrile.
Chemical Property Profile of 2-[1-Methoxy-3-(4-nitroanilino)prop-2-enylidene]propanedinitrile
Property Insights of 2-[1-Methoxy-3-(4-nitroanilino)prop-2-enylidene]propanedinitrile
The XLogP value of 2.46806 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-[1-Methoxy-3-(4-nitroanilino)prop-2-enylidene]propanedinitrile. The TPSA of 111.98 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[1-Methoxy-3-(4-nitroanilino)prop-2-enylidene]propanedinitrile. Following Lipinski's Rule of Five, 2-[1-Methoxy-3-(4-nitroanilino)prop-2-enylidene]propanedinitrile has 1 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 2-[1-Methoxy-3-(4-nitroanilino)prop-2-enylidene]propanedinitrile?
The CAS number of 2-[1-Methoxy-3-(4-nitroanilino)prop-2-enylidene]propanedinitrile is 341966-92-5.
What is the molecular formula of 2-[1-Methoxy-3-(4-nitroanilino)prop-2-enylidene]propanedinitrile?
The molecular formula of 2-[1-Methoxy-3-(4-nitroanilino)prop-2-enylidene]propanedinitrile is C13H10N4O3.
What is the molecular weight of 2-[1-Methoxy-3-(4-nitroanilino)prop-2-enylidene]propanedinitrile?
The molecular weight of 2-[1-Methoxy-3-(4-nitroanilino)prop-2-enylidene]propanedinitrile is 270.08 g/mol.
Where can I buy 2-[1-Methoxy-3-(4-nitroanilino)prop-2-enylidene]propanedinitrile?
You can request a quote for 2-[1-Methoxy-3-(4-nitroanilino)prop-2-enylidene]propanedinitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[1-Methoxy-3-(4-nitroanilino)prop-2-enylidene]propanedinitrile?
Yes, KEHONG BIO provides custom synthesis services for 2-[1-Methoxy-3-(4-nitroanilino)prop-2-enylidene]propanedinitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.