(1E)-N-anilino-2-(azepan-1-yl)-2-iminoethanimidoyl cyanide
TL;DR: (1E)-N-anilino-2-(azepan-1-yl)-2-iminoethanimidoyl cyanide (CAS 304870-56-2) is a chemical compound with molecular formula C15H19N5 and molecular weight 269.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1E)-N-anilino-2-(azepan-1-yl)-2-iminoethanimidoyl cyanide
Also Known As: (1E)-N-anilino-2-(azepan-1-yl)-2-iminoethanimidoyl cyanide, 3-Azepan-1-yl-3-imino-2-(phenyl-hydrazono)-propionitrile, (2E)-3-(azepan-1-yl)-3-imino-2-(2-phenylhydrazinylidene)propanenitrile, (E)-2-(azepan-1-yl)-2-imino-N'-phenylacetohydrazonoyl cyanide
| Molecular Formula | C15H19N5 |
|---|---|
| Molecular Weight | 269.16 g/mol |
| LogP | 2.83135 |
| Topological Polar Surface Area | 75.27 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 269.16403 |
| Heavy Atoms | 20 |
| Complexity | 506.81546 |
Chemical Identifiers
| CAS Number | 304870-56-2 |
|---|---|
| SMILES | C1CCCN(CC1)C(=N)/C(=N/NC2=CC=CC=C2)/C#N |
Product Overview
(1E)-N-anilino-2-(azepan-1-yl)-2-iminoethanimidoyl cyanide (CAS 304870-56-2), with molecular formula C15H19N5 and molecular weight 269.16 g/mol. IUPAC: (1E)-N-anilino-2-(azepan-1-yl)-2-iminoethanimidoyl cyanide.
Chemical Property Profile of (1E)-N-anilino-2-(azepan-1-yl)-2-iminoethanimidoyl cyanide
Property Insights of (1E)-N-anilino-2-(azepan-1-yl)-2-iminoethanimidoyl cyanide
The XLogP value of 2.83135 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (1E)-N-anilino-2-(azepan-1-yl)-2-iminoethanimidoyl cyanide. The TPSA of 75.27 Ų falls within the moderate polarity range, balancing permeability and solubility for (1E)-N-anilino-2-(azepan-1-yl)-2-iminoethanimidoyl cyanide. Following Lipinski's Rule of Five, (1E)-N-anilino-2-(azepan-1-yl)-2-iminoethanimidoyl cyanide has 2 hydrogen bond donor(s) and 4 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 (1E)-N-anilino-2-(azepan-1-yl)-2-iminoethanimidoyl cyanide?
The CAS number of (1E)-N-anilino-2-(azepan-1-yl)-2-iminoethanimidoyl cyanide is 304870-56-2.
What is the molecular formula of (1E)-N-anilino-2-(azepan-1-yl)-2-iminoethanimidoyl cyanide?
The molecular formula of (1E)-N-anilino-2-(azepan-1-yl)-2-iminoethanimidoyl cyanide is C15H19N5.
What is the molecular weight of (1E)-N-anilino-2-(azepan-1-yl)-2-iminoethanimidoyl cyanide?
The molecular weight of (1E)-N-anilino-2-(azepan-1-yl)-2-iminoethanimidoyl cyanide is 269.16 g/mol.
Where can I buy (1E)-N-anilino-2-(azepan-1-yl)-2-iminoethanimidoyl cyanide?
You can request a quote for (1E)-N-anilino-2-(azepan-1-yl)-2-iminoethanimidoyl cyanide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (1E)-N-anilino-2-(azepan-1-yl)-2-iminoethanimidoyl cyanide?
Yes, KEHONG BIO provides custom synthesis services for (1E)-N-anilino-2-(azepan-1-yl)-2-iminoethanimidoyl cyanide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.