Imidazole-4-carboxanilide
TL;DR: Imidazole-4-carboxanilide (CAS 13189-13-4) is a chemical compound with molecular formula C10H9N3O and molecular weight 187.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-phenyl-1H-imidazole-5-carboxamide
Also Known As: N-phenyl-1H-imidazole-5-carboxamide, Imidazole-4-carboxanilide, 4-(Anilinocarbonyl)imidazole, n-phenyl-1h-imidazole-4-carboxamide, ChemDiv3_000821
| Molecular Formula | C10H9N3O |
|---|---|
| Molecular Weight | 187.07 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 57.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 187.07455 |
| Heavy Atoms | 14 |
| Complexity | 202.0 |
Chemical Identifiers
| CAS Number | 13189-13-4 |
|---|---|
| SMILES | C1=CC=C(C=C1)NC(=O)C2=CN=CN2 |
| InChIKey | HYPSKNLBXKFNBB-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Imidazole-4-carboxanilide (CAS 13189-13-4), with molecular formula C10H9N3O and molecular weight 187.07 g/mol. IUPAC: N-phenyl-1H-imidazole-5-carboxamide.
Chemical Property Profile of Imidazole-4-carboxanilide
Property Insights of Imidazole-4-carboxanilide
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Imidazole-4-carboxanilide. With a topological polar surface area (TPSA) of 57.8 Ų, Imidazole-4-carboxanilide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Imidazole-4-carboxanilide 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 Imidazole-4-carboxanilide?
The CAS number of Imidazole-4-carboxanilide is 13189-13-4.
What is the molecular formula of Imidazole-4-carboxanilide?
The molecular formula of Imidazole-4-carboxanilide is C10H9N3O.
What is the molecular weight of Imidazole-4-carboxanilide?
The molecular weight of Imidazole-4-carboxanilide is 187.07 g/mol.
Where can I buy Imidazole-4-carboxanilide?
You can request a quote for Imidazole-4-carboxanilide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Imidazole-4-carboxanilide?
Yes, KEHONG BIO provides custom synthesis services for Imidazole-4-carboxanilide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.