2-Carbamoyl-1-methylbenzimidazole
TL;DR: 2-Carbamoyl-1-methylbenzimidazole (CAS 5805-75-4) is a chemical compound with molecular formula C9H9N3O and molecular weight 175.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-methylbenzimidazole-2-carboxamide
Also Known As: 1-methylbenzimidazole-2-carboxamide, 2-Carbamoyl-1-methylbenzimidazole, 1-methyl-1H-1,3-benzodiazole-2-carboxamide, 1-Methyl-1H-benzimidazole-2-carboxamide, 1-Methyl-2-benzimidazolecarboxamide
| Molecular Formula | C9H9N3O |
|---|---|
| Molecular Weight | 175.07 g/mol |
| LogP | 0.5 |
| Topological Polar Surface Area | 60.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 175.07455 |
| Heavy Atoms | 13 |
| Complexity | 219.0 |
Chemical Identifiers
| CAS Number | 5805-75-4 |
|---|---|
| SMILES | CN1C2=CC=CC=C2N=C1C(=O)N |
| InChIKey | FPVBBVKUKKJRSV-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-Carbamoyl-1-methylbenzimidazole (CAS 5805-75-4), with molecular formula C9H9N3O and molecular weight 175.07 g/mol. IUPAC: 1-methylbenzimidazole-2-carboxamide.
Chemical Property Profile of 2-Carbamoyl-1-methylbenzimidazole
Property Insights of 2-Carbamoyl-1-methylbenzimidazole
The XLogP value of 0.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Carbamoyl-1-methylbenzimidazole. The TPSA of 60.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Carbamoyl-1-methylbenzimidazole. Following Lipinski's Rule of Five, 2-Carbamoyl-1-methylbenzimidazole has 1 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 2-Carbamoyl-1-methylbenzimidazole?
The CAS number of 2-Carbamoyl-1-methylbenzimidazole is 5805-75-4.
What is the molecular formula of 2-Carbamoyl-1-methylbenzimidazole?
The molecular formula of 2-Carbamoyl-1-methylbenzimidazole is C9H9N3O.
What is the molecular weight of 2-Carbamoyl-1-methylbenzimidazole?
The molecular weight of 2-Carbamoyl-1-methylbenzimidazole is 175.07 g/mol.
Where can I buy 2-Carbamoyl-1-methylbenzimidazole?
You can request a quote for 2-Carbamoyl-1-methylbenzimidazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Carbamoyl-1-methylbenzimidazole?
Yes, KEHONG BIO provides custom synthesis services for 2-Carbamoyl-1-methylbenzimidazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.