4-chloro-N-(pyridine-4-carbonylamino)benzenecarboximidoyl cyanide
TL;DR: 4-chloro-N-(pyridine-4-carbonylamino)benzenecarboximidoyl cyanide (CAS 90017-04-2) is a chemical compound with molecular formula C14H9ClN4O and molecular weight 284.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-chloro-N-(pyridine-4-carbonylamino)benzenecarboximidoyl cyanide
Also Known As: (1Z)-4-chloro-N-(pyridine-4-carbonylamino)benzenecarboximido, 4-chloro-N-(pyridine-4-carbonylamino)benzenecarboximidoyl cyanide
| Molecular Formula | C14H9ClN4O |
|---|---|
| Molecular Weight | 284.05 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 78.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 284.04648 |
| Heavy Atoms | 20 |
| Complexity | 414.0 |
Chemical Identifiers
| CAS Number | 90017-04-2 |
|---|---|
| SMILES | C1=CC(=CC=C1C(=NNC(=O)C2=CC=NC=C2)C#N)Cl |
| InChIKey | UBZBDWVLSQRBNU-UHFFFAOYSA-N |
Product Overview
4-chloro-N-(pyridine-4-carbonylamino)benzenecarboximidoyl cyanide (CAS 90017-04-2), with molecular formula C14H9ClN4O and molecular weight 284.05 g/mol. IUPAC: 4-chloro-N-(pyridine-4-carbonylamino)benzenecarboximidoyl cyanide.
Chemical Property Profile of 4-chloro-N-(pyridine-4-carbonylamino)benzenecarboximidoyl cyanide
Property Insights of 4-chloro-N-(pyridine-4-carbonylamino)benzenecarboximidoyl cyanide
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-chloro-N-(pyridine-4-carbonylamino)benzenecarboximidoyl cyanide. The TPSA of 78.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-chloro-N-(pyridine-4-carbonylamino)benzenecarboximidoyl cyanide. Following Lipinski's Rule of Five, 4-chloro-N-(pyridine-4-carbonylamino)benzenecarboximidoyl cyanide has 1 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 4-chloro-N-(pyridine-4-carbonylamino)benzenecarboximidoyl cyanide?
The CAS number of 4-chloro-N-(pyridine-4-carbonylamino)benzenecarboximidoyl cyanide is 90017-04-2.
What is the molecular formula of 4-chloro-N-(pyridine-4-carbonylamino)benzenecarboximidoyl cyanide?
The molecular formula of 4-chloro-N-(pyridine-4-carbonylamino)benzenecarboximidoyl cyanide is C14H9ClN4O.
What is the molecular weight of 4-chloro-N-(pyridine-4-carbonylamino)benzenecarboximidoyl cyanide?
The molecular weight of 4-chloro-N-(pyridine-4-carbonylamino)benzenecarboximidoyl cyanide is 284.05 g/mol.
Where can I buy 4-chloro-N-(pyridine-4-carbonylamino)benzenecarboximidoyl cyanide?
You can request a quote for 4-chloro-N-(pyridine-4-carbonylamino)benzenecarboximidoyl cyanide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-chloro-N-(pyridine-4-carbonylamino)benzenecarboximidoyl cyanide?
Yes, KEHONG BIO provides custom synthesis services for 4-chloro-N-(pyridine-4-carbonylamino)benzenecarboximidoyl cyanide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.