![[(1-ethyl-1H-indol-3-yl)methylidene]propanedinitrile structure](/static/products/420/420814-93-3.png)
[(1-ethyl-1H-indol-3-yl)methylidene]propanedinitrile
TL;DR: [(1-ethyl-1H-indol-3-yl)methylidene]propanedinitrile (CAS 420814-93-3) is a chemical compound with molecular formula C14H11N3 and molecular weight 221.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(1-ethylindol-3-yl)methylidene]propanedinitrile
Also Known As: BAS 03347323, ((1-ethyl-1h-indol-3-yl)methylene)malononitrile, [(1-ethyl-1H-indol-3-yl)methylidene]propanedinitrile, [(1-ethyl-1H-indol-3-yl)methylene]malononitrile, 2-(1-Ethyl-1H-indol-3-ylmethylene)-malononitrile
| Molecular Formula | C14H11N3 |
|---|---|
| Molecular Weight | 221.10 g/mol |
| LogP | 3.09176 |
| Topological Polar Surface Area | 52.51 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 221.09529 |
| Heavy Atoms | 17 |
| Complexity | 646.8126 |
Chemical Identifiers
| CAS Number | 420814-93-3 |
|---|---|
| SMILES | CCN1C=C(C2=CC=CC=C21)C=C(C#N)C#N |
Product Overview
[(1-ethyl-1H-indol-3-yl)methylidene]propanedinitrile (CAS 420814-93-3), with molecular formula C14H11N3 and molecular weight 221.10 g/mol. IUPAC: 2-[(1-ethylindol-3-yl)methylidene]propanedinitrile.
Chemical Property Profile of [(1-ethyl-1H-indol-3-yl)methylidene]propanedinitrile
Property Insights of [(1-ethyl-1H-indol-3-yl)methylidene]propanedinitrile
The XLogP value of 3.09176 indicates that [(1-ethyl-1H-indol-3-yl)methylidene]propanedinitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.51 Ų, [(1-ethyl-1H-indol-3-yl)methylidene]propanedinitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, [(1-ethyl-1H-indol-3-yl)methylidene]propanedinitrile has 0 hydrogen bond donor(s) and 2 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 [(1-ethyl-1H-indol-3-yl)methylidene]propanedinitrile?
The CAS number of [(1-ethyl-1H-indol-3-yl)methylidene]propanedinitrile is 420814-93-3.
What is the molecular formula of [(1-ethyl-1H-indol-3-yl)methylidene]propanedinitrile?
The molecular formula of [(1-ethyl-1H-indol-3-yl)methylidene]propanedinitrile is C14H11N3.
What is the molecular weight of [(1-ethyl-1H-indol-3-yl)methylidene]propanedinitrile?
The molecular weight of [(1-ethyl-1H-indol-3-yl)methylidene]propanedinitrile is 221.10 g/mol.
Where can I buy [(1-ethyl-1H-indol-3-yl)methylidene]propanedinitrile?
You can request a quote for [(1-ethyl-1H-indol-3-yl)methylidene]propanedinitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [(1-ethyl-1H-indol-3-yl)methylidene]propanedinitrile?
Yes, KEHONG BIO provides custom synthesis services for [(1-ethyl-1H-indol-3-yl)methylidene]propanedinitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.