1H-Imidazole-4,5-dicarboxamide, N,N'-dibutyl-
TL;DR: 1H-Imidazole-4,5-dicarboxamide, N,N'-dibutyl- (CAS 62254-97-1) is a chemical compound with molecular formula C13H22N4O2 and molecular weight 266.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-N,5-N-dibutyl-1H-imidazole-4,5-dicarboxamide
Also Known As: 1H-Imidazole-4,5-dicarboxamide, N,N'-dibutyl-, Imidazol-4,5-dicarboxamide, N,N'-dibutyl-, 4-N,5-N-dibutyl-1H-imidazole-4,5-dicarboxamide, J1.843.716C, N,N -Dibutyl-1H-imidazole-4,5-dicarboxamide
| Molecular Formula | C13H22N4O2 |
|---|---|
| Molecular Weight | 266.17 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 86.9 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 8 |
| Exact Mass | 266.1743 |
| Heavy Atoms | 19 |
| Complexity | 296.0 |
Chemical Identifiers
| CAS Number | 62254-97-1 |
|---|---|
| SMILES | CCCCNC(=O)C1=C(N=CN1)C(=O)NCCCC |
| InChIKey | QVIQJOLYGPTMSX-UHFFFAOYSA-N |
Product Overview
1H-Imidazole-4,5-dicarboxamide, N,N'-dibutyl- (CAS 62254-97-1), with molecular formula C13H22N4O2 and molecular weight 266.17 g/mol. IUPAC: 4-N,5-N-dibutyl-1H-imidazole-4,5-dicarboxamide.
Chemical Property Profile of 1H-Imidazole-4,5-dicarboxamide, N,N'-dibutyl-
Property Insights of 1H-Imidazole-4,5-dicarboxamide, N,N'-dibutyl-
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1H-Imidazole-4,5-dicarboxamide, N,N'-dibutyl-. The TPSA of 86.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 1H-Imidazole-4,5-dicarboxamide, N,N'-dibutyl-. Following Lipinski's Rule of Five, 1H-Imidazole-4,5-dicarboxamide, N,N'-dibutyl- 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
Frequently Asked Questions
What is the CAS number of 1H-Imidazole-4,5-dicarboxamide, N,N'-dibutyl-?
The CAS number of 1H-Imidazole-4,5-dicarboxamide, N,N'-dibutyl- is 62254-97-1.
What is the molecular formula of 1H-Imidazole-4,5-dicarboxamide, N,N'-dibutyl-?
The molecular formula of 1H-Imidazole-4,5-dicarboxamide, N,N'-dibutyl- is C13H22N4O2.
What is the molecular weight of 1H-Imidazole-4,5-dicarboxamide, N,N'-dibutyl-?
The molecular weight of 1H-Imidazole-4,5-dicarboxamide, N,N'-dibutyl- is 266.17 g/mol.
Where can I buy 1H-Imidazole-4,5-dicarboxamide, N,N'-dibutyl-?
You can request a quote for 1H-Imidazole-4,5-dicarboxamide, N,N'-dibutyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1H-Imidazole-4,5-dicarboxamide, N,N'-dibutyl-?
Yes, KEHONG BIO provides custom synthesis services for 1H-Imidazole-4,5-dicarboxamide, N,N'-dibutyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.