![2-[(N-methylanilino)methylidene]propanedinitrile structure](/static/products/2411/24115-28-4.webp)
2-[(N-methylanilino)methylidene]propanedinitrile
TL;DR: 2-[(N-methylanilino)methylidene]propanedinitrile (CAS 24115-28-4) is a chemical compound with molecular formula C11H9N3 and molecular weight 183.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(N-methylanilino)methylidene]propanedinitrile
Also Known As: 2-[(N-methylanilino)methylidene]propanedinitrile, {[Methyl(phenyl)amino]methylidene}propanedinitrile
| Molecular Formula | C11H9N3 |
|---|---|
| Molecular Weight | 183.08 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 50.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 183.07965 |
| Heavy Atoms | 14 |
| Complexity | 288.0 |
Chemical Identifiers
| CAS Number | 24115-28-4 |
|---|---|
| SMILES | CN(C=C(C#N)C#N)C1=CC=CC=C1 |
| InChIKey | PSCBIEVLEFKPTH-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-[(N-methylanilino)methylidene]propanedinitrile (CAS 24115-28-4), with molecular formula C11H9N3 and molecular weight 183.08 g/mol. IUPAC: 2-[(N-methylanilino)methylidene]propanedinitrile.
Chemical Property Profile of 2-[(N-methylanilino)methylidene]propanedinitrile
Property Insights of 2-[(N-methylanilino)methylidene]propanedinitrile
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-[(N-methylanilino)methylidene]propanedinitrile. With a topological polar surface area (TPSA) of 50.8 Ų, 2-[(N-methylanilino)methylidene]propanedinitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-[(N-methylanilino)methylidene]propanedinitrile has 0 hydrogen bond donor(s) and 3 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-[(N-methylanilino)methylidene]propanedinitrile?
The CAS number of 2-[(N-methylanilino)methylidene]propanedinitrile is 24115-28-4.
What is the molecular formula of 2-[(N-methylanilino)methylidene]propanedinitrile?
The molecular formula of 2-[(N-methylanilino)methylidene]propanedinitrile is C11H9N3.
What is the molecular weight of 2-[(N-methylanilino)methylidene]propanedinitrile?
The molecular weight of 2-[(N-methylanilino)methylidene]propanedinitrile is 183.08 g/mol.
Where can I buy 2-[(N-methylanilino)methylidene]propanedinitrile?
You can request a quote for 2-[(N-methylanilino)methylidene]propanedinitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[(N-methylanilino)methylidene]propanedinitrile?
Yes, KEHONG BIO provides custom synthesis services for 2-[(N-methylanilino)methylidene]propanedinitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.