5-Amino-1-(p-tolyl)imidazole-4-carboximidoyl cyanide
TL;DR: 5-Amino-1-(p-tolyl)imidazole-4-carboximidoyl cyanide (CAS 155579-32-1) is a chemical compound with molecular formula C12H11N5 and molecular weight 225.10144 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-amino-1-(4-methylphenyl)imidazole-4-carboximidoyl cyanide
Also Known As: NCI60_024664, J1.541.619J, [5-amino-1-(p-tolyl)-1H-imidazol-4-yl](imino)acetonitrile, 5-amino-1-(p-tolyl)imidazole-4-carboximidoyl cyanide, [1-(4-Methylphenyl)-5-amino-4-imidazolyl](imino)acetonitrile
Technical Specifications
| Molecular Formula | C12H11N5 |
| Molecular Weight | 225.10144 g/mol |
| XLogP | 1.7 |
| Topological Polar Surface Area (TPSA) | 91.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 225.10144 Da |
| Heavy Atoms | 17 |
| Complexity | 336.0 |
| SMILES | CC1=CC=C(C=C1)N2C=NC(=C2N)C(=N)C#N |
| InChIKey | TYZNVRLNICTQCG-UHFFFAOYSA-N |
Chemical Property Profile of 5-Amino-1-(p-tolyl)imidazole-4-carboximidoyl cyanide
Property Insights of 5-Amino-1-(p-tolyl)imidazole-4-carboximidoyl cyanide
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Amino-1-(p-tolyl)imidazole-4-carboximidoyl cyanide. The TPSA of 91.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-Amino-1-(p-tolyl)imidazole-4-carboximidoyl cyanide. Following Lipinski's Rule of Five, 5-Amino-1-(p-tolyl)imidazole-4-carboximidoyl 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
What is the CAS number of 5-Amino-1-(p-tolyl)imidazole-4-carboximidoyl cyanide?
The CAS number of 5-Amino-1-(p-tolyl)imidazole-4-carboximidoyl cyanide is 155579-32-1.
What is the molecular formula of 5-Amino-1-(p-tolyl)imidazole-4-carboximidoyl cyanide?
The molecular formula of 5-Amino-1-(p-tolyl)imidazole-4-carboximidoyl cyanide is C12H11N5.
What is the molecular weight of 5-Amino-1-(p-tolyl)imidazole-4-carboximidoyl cyanide?
The molecular weight of 5-Amino-1-(p-tolyl)imidazole-4-carboximidoyl cyanide is 225.10144 g/mol.
Where can I buy 5-Amino-1-(p-tolyl)imidazole-4-carboximidoyl cyanide?
You can request a quote for 5-Amino-1-(p-tolyl)imidazole-4-carboximidoyl cyanide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 5-Amino-1-(p-tolyl)imidazole-4-carboximidoyl cyanide?
Yes, CoreyChem provides custom synthesis services for 5-Amino-1-(p-tolyl)imidazole-4-carboximidoyl cyanide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.