N4,N5-Dimethyl-1H-imidazole-4,5-dicarboxamide
TL;DR: N4,N5-Dimethyl-1H-imidazole-4,5-dicarboxamide (CAS 3691-03-0) is a chemical compound with molecular formula C7H10N4O2 and molecular weight 182.08037 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-N,5-N-dimethyl-1H-imidazole-4,5-dicarboxamide
Also Known As: Norantifeine, Norantiffein, IEM 163, 1H-Imidazole-4,5-dicarboxamide, N,N'-dimethyl-, N,N'-Dimethylimidazole-4,5-dicarboxamide
Technical Specifications
| Molecular Formula | C7H10N4O2 |
| Molecular Weight | 182.08037 g/mol |
| XLogP | -0.7 |
| Topological Polar Surface Area (TPSA) | 86.9 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 182.08037 Da |
| Heavy Atoms | 13 |
| Complexity | 219.0 |
| SMILES | CNC(=O)C1=C(N=CN1)C(=O)NC |
| InChIKey | FDMDLNWXKUUKOU-UHFFFAOYSA-N |
Chemical Property Profile of N4,N5-Dimethyl-1H-imidazole-4,5-dicarboxamide
Property Insights of N4,N5-Dimethyl-1H-imidazole-4,5-dicarboxamide
The XLogP value of -0.7 indicates that N4,N5-Dimethyl-1H-imidazole-4,5-dicarboxamide is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 86.9 Ų falls within the moderate polarity range, balancing permeability and solubility for N4,N5-Dimethyl-1H-imidazole-4,5-dicarboxamide. Following Lipinski's Rule of Five, N4,N5-Dimethyl-1H-imidazole-4,5-dicarboxamide has 3 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of N4,N5-Dimethyl-1H-imidazole-4,5-dicarboxamide?
The CAS number of N4,N5-Dimethyl-1H-imidazole-4,5-dicarboxamide is 3691-03-0.
What is the molecular formula of N4,N5-Dimethyl-1H-imidazole-4,5-dicarboxamide?
The molecular formula of N4,N5-Dimethyl-1H-imidazole-4,5-dicarboxamide is C7H10N4O2.
What is the molecular weight of N4,N5-Dimethyl-1H-imidazole-4,5-dicarboxamide?
The molecular weight of N4,N5-Dimethyl-1H-imidazole-4,5-dicarboxamide is 182.08037 g/mol.
Where can I buy N4,N5-Dimethyl-1H-imidazole-4,5-dicarboxamide?
You can request a quote for N4,N5-Dimethyl-1H-imidazole-4,5-dicarboxamide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for N4,N5-Dimethyl-1H-imidazole-4,5-dicarboxamide?
Yes, CoreyChem provides custom synthesis services for N4,N5-Dimethyl-1H-imidazole-4,5-dicarboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.