1-(Propan-2-yl)-2-(trifluoromethyl)-1H-benzimidazole-5-carboxylic acid
TL;DR: 1-(Propan-2-yl)-2-(trifluoromethyl)-1H-benzimidazole-5-carboxylic acid (CAS 306935-42-2) is a chemical compound with molecular formula C12H11F3N2O2 and molecular weight 272.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-propan-2-yl-2-(trifluoromethyl)benzimidazole-5-carboxylic acid
Also Known As: 1-Isopropyl-2-(trifluoromethyl)-1h-benzimidazole-5-carboxylic acid, Maybridge1_005158, 1-propan-2-yl-2-(trifluoromethyl)benzimidazole-5-carboxylic acid, 1-(propan-2-yl)-2-(trifluoromethyl)-1H-1,3-benzodiazole-5-carboxylic acid, 1H-Benzimidazole-5-carboxylic acid, 1-(1-methylethyl)-2-(trifluoromethyl)-
| Molecular Formula | C12H11F3N2O2 |
|---|---|
| Molecular Weight | 272.08 g/mol |
| LogP | 3.3342 |
| Topological Polar Surface Area | 55.12 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 272.07727 |
| Heavy Atoms | 19 |
| Complexity | 644.19727 |
Chemical Identifiers
| CAS Number | 306935-42-2 |
|---|---|
| SMILES | CC(C)N1C2=C(C=C(C=C2)C(=O)O)N=C1C(F)(F)F |
Product Overview
1-(Propan-2-yl)-2-(trifluoromethyl)-1H-benzimidazole-5-carboxylic acid (CAS 306935-42-2), with molecular formula C12H11F3N2O2 and molecular weight 272.08 g/mol. IUPAC: 1-propan-2-yl-2-(trifluoromethyl)benzimidazole-5-carboxylic acid.
Chemical Property Profile of 1-(Propan-2-yl)-2-(trifluoromethyl)-1H-benzimidazole-5-carboxylic acid
Property Insights of 1-(Propan-2-yl)-2-(trifluoromethyl)-1H-benzimidazole-5-carboxylic acid
The XLogP value of 3.3342 indicates that 1-(Propan-2-yl)-2-(trifluoromethyl)-1H-benzimidazole-5-carboxylic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.12 Ų, 1-(Propan-2-yl)-2-(trifluoromethyl)-1H-benzimidazole-5-carboxylic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(Propan-2-yl)-2-(trifluoromethyl)-1H-benzimidazole-5-carboxylic acid 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 1-(Propan-2-yl)-2-(trifluoromethyl)-1H-benzimidazole-5-carboxylic acid?
The CAS number of 1-(Propan-2-yl)-2-(trifluoromethyl)-1H-benzimidazole-5-carboxylic acid is 306935-42-2.
What is the molecular formula of 1-(Propan-2-yl)-2-(trifluoromethyl)-1H-benzimidazole-5-carboxylic acid?
The molecular formula of 1-(Propan-2-yl)-2-(trifluoromethyl)-1H-benzimidazole-5-carboxylic acid is C12H11F3N2O2.
What is the molecular weight of 1-(Propan-2-yl)-2-(trifluoromethyl)-1H-benzimidazole-5-carboxylic acid?
The molecular weight of 1-(Propan-2-yl)-2-(trifluoromethyl)-1H-benzimidazole-5-carboxylic acid is 272.08 g/mol.
Where can I buy 1-(Propan-2-yl)-2-(trifluoromethyl)-1H-benzimidazole-5-carboxylic acid?
You can request a quote for 1-(Propan-2-yl)-2-(trifluoromethyl)-1H-benzimidazole-5-carboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(Propan-2-yl)-2-(trifluoromethyl)-1H-benzimidazole-5-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 1-(Propan-2-yl)-2-(trifluoromethyl)-1H-benzimidazole-5-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.