Imidazolecarboxamide
TL;DR: Imidazolecarboxamide (CAS 85117-98-2) is a chemical compound with molecular formula C1=CN=C(N1)C(=O)N and molecular weight 111.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1H-imidazole-2-carboxamide
Also Known As: 1H-Imidazole-2-carboxamide, Imidazolecarboxamide, Imidazole carboxamide, imidazole amide, Imidazolcarboxamide
| Molecular Formula | C1=CN=C(N1)C(=O)N |
|---|---|
| Molecular Weight | 111.04 g/mol |
| LogP | -0.7 |
| Topological Polar Surface Area | 71.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 111.04326 |
| Heavy Atoms | 8 |
| Complexity | 103.0 |
Chemical Identifiers
| CAS Number | 85117-98-2 |
|---|---|
| SMILES | C1=CN=C(N1)C(=O)N |
| InChIKey | NMIZONYLXCOHEF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 14 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Imidazolecarboxamide (CAS 85117-98-2), with molecular formula C1=CN=C(N1)C(=O)N and molecular weight 111.04 g/mol. IUPAC: 1H-imidazole-2-carboxamide.
Chemical Property Profile of Imidazolecarboxamide
Property Insights of Imidazolecarboxamide
The XLogP value of -0.7 indicates that Imidazolecarboxamide is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 71.8 Ų falls within the moderate polarity range, balancing permeability and solubility for Imidazolecarboxamide. Following Lipinski's Rule of Five, Imidazolecarboxamide has 2 hydrogen bond donor(s) and 2 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 Imidazolecarboxamide?
The CAS number of Imidazolecarboxamide is 85117-98-2.
What is the molecular formula of Imidazolecarboxamide?
The molecular formula of Imidazolecarboxamide is C1=CN=C(N1)C(=O)N.
What is the molecular weight of Imidazolecarboxamide?
The molecular weight of Imidazolecarboxamide is 111.04 g/mol.
Where can I buy Imidazolecarboxamide?
You can request a quote for Imidazolecarboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Imidazolecarboxamide?
Yes, KEHONG BIO provides custom synthesis services for Imidazolecarboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.