2-(2-Propan-2-ylbenzimidazole-1-carbonyl)benzoic acid
TL;DR: 2-(2-Propan-2-ylbenzimidazole-1-carbonyl)benzoic acid (CAS 537010-76-7) is a chemical compound with molecular formula C18H16N2O3 and molecular weight 308.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2-propan-2-ylbenzimidazole-1-carbonyl)benzoic acid
Also Known As: ChemDiv3_005015, IDI1_022925, 2-(2-propan-2-ylbenzimidazole-1-carbonyl)benzoic acid, AB00673660-01, AF-399/41368254
| Molecular Formula | C18H16N2O3 |
|---|---|
| Molecular Weight | 308.12 g/mol |
| LogP | 3.7 |
| Topological Polar Surface Area | 72.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 308.1161 |
| Heavy Atoms | 23 |
| Complexity | 465.0 |
Chemical Identifiers
| CAS Number | 537010-76-7 |
|---|---|
| SMILES | CC(C)C1=NC2=CC=CC=C2N1C(=O)C3=CC=CC=C3C(=O)O |
| InChIKey | BBGQPPVLFOWBAH-UHFFFAOYSA-N |
Product Overview
2-(2-Propan-2-ylbenzimidazole-1-carbonyl)benzoic acid (CAS 537010-76-7), with molecular formula C18H16N2O3 and molecular weight 308.12 g/mol. IUPAC: 2-(2-propan-2-ylbenzimidazole-1-carbonyl)benzoic acid.
Chemical Property Profile of 2-(2-Propan-2-ylbenzimidazole-1-carbonyl)benzoic acid
Property Insights of 2-(2-Propan-2-ylbenzimidazole-1-carbonyl)benzoic acid
The XLogP value of 3.7 indicates that 2-(2-Propan-2-ylbenzimidazole-1-carbonyl)benzoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 72.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(2-Propan-2-ylbenzimidazole-1-carbonyl)benzoic acid. Following Lipinski's Rule of Five, 2-(2-Propan-2-ylbenzimidazole-1-carbonyl)benzoic acid has 1 hydrogen bond donor(s) and 4 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-(2-Propan-2-ylbenzimidazole-1-carbonyl)benzoic acid?
The CAS number of 2-(2-Propan-2-ylbenzimidazole-1-carbonyl)benzoic acid is 537010-76-7.
What is the molecular formula of 2-(2-Propan-2-ylbenzimidazole-1-carbonyl)benzoic acid?
The molecular formula of 2-(2-Propan-2-ylbenzimidazole-1-carbonyl)benzoic acid is C18H16N2O3.
What is the molecular weight of 2-(2-Propan-2-ylbenzimidazole-1-carbonyl)benzoic acid?
The molecular weight of 2-(2-Propan-2-ylbenzimidazole-1-carbonyl)benzoic acid is 308.12 g/mol.
Where can I buy 2-(2-Propan-2-ylbenzimidazole-1-carbonyl)benzoic acid?
You can request a quote for 2-(2-Propan-2-ylbenzimidazole-1-carbonyl)benzoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(2-Propan-2-ylbenzimidazole-1-carbonyl)benzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-(2-Propan-2-ylbenzimidazole-1-carbonyl)benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.