1-2- imidazole-1,2-dicarboxamide
TL;DR: 1-2- imidazole-1,2-dicarboxamide (CAS 139109-16-3) is a chemical compound with molecular formula C18H13F3N4O2 and molecular weight 374.09906 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-N-phenyl-1-N-[3-(trifluoromethyl)phenyl]imidazole-1,2-dicarboxamide
Also Known As: 1-2- imidazole-1,2-dicarboxamide, 1- -2- imidazole-1,2-dicarboxamide, 1H-Imidazole-1,2-dicarboxamide, N(sup 2)-phenyl-N(sup 1)-(3-(trifluoromethyl)phenyl)-, 1-(N-m-Trifluoromethylphenyl)-2-(N-phenyl)imidazole-1,2-dicarboxamide, N(sup 2)-Phenyl-N(sup 1)-(3-(trifluoromethyl)phenyl)-1H-imidazole-1,2-dicarboxamide
Technical Specifications
| Molecular Formula | C18H13F3N4O2 |
| Molecular Weight | 374.09906 g/mol |
| XLogP | 3.3 |
| Topological Polar Surface Area (TPSA) | 76.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 374.09906 Da |
| Heavy Atoms | 27 |
| Complexity | 537.0 |
| SMILES | C1=CC=C(C=C1)NC(=O)C2=NC=CN2C(=O)NC3=CC=CC(=C3)C(F)(F)F |
| InChIKey | NWVCUMFKBZTJCE-UHFFFAOYSA-N |
Chemical Property Profile of 1-2- imidazole-1,2-dicarboxamide
Property Insights of 1-2- imidazole-1,2-dicarboxamide
The XLogP value of 3.3 indicates that 1-2- imidazole-1,2-dicarboxamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 76.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-2- imidazole-1,2-dicarboxamide. Following Lipinski's Rule of Five, 1-2- imidazole-1,2-dicarboxamide has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 1-2- imidazole-1,2-dicarboxamide?
The CAS number of 1-2- imidazole-1,2-dicarboxamide is 139109-16-3.
What is the molecular formula of 1-2- imidazole-1,2-dicarboxamide?
The molecular formula of 1-2- imidazole-1,2-dicarboxamide is C18H13F3N4O2.
What is the molecular weight of 1-2- imidazole-1,2-dicarboxamide?
The molecular weight of 1-2- imidazole-1,2-dicarboxamide is 374.09906 g/mol.
Where can I buy 1-2- imidazole-1,2-dicarboxamide?
You can request a quote for 1-2- imidazole-1,2-dicarboxamide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1-2- imidazole-1,2-dicarboxamide?
Yes, CoreyChem provides custom synthesis services for 1-2- imidazole-1,2-dicarboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.