2,3-Dihydro-3-methyl-2-oxo-1H-benzimidazole-1-propanoic acid
TL;DR: 2,3-Dihydro-3-methyl-2-oxo-1H-benzimidazole-1-propanoic acid (CAS 75655-45-7) is a chemical compound with molecular formula C11H12N2O3 and molecular weight 220.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(3-methyl-2-oxobenzimidazol-1-yl)propanoic acid
Also Known As: 3-(3-Methyl-2-oxo-2,3-dihydro-benzoimidazol-1-yl)-propionic acid, 3-(3-methyl-2-oxobenzimidazol-1-yl)propanoic acid, 3-(3-methyl-2-oxo-2,3-dihydro-1H-benzimidazol-1-yl)propanoic acid, 3-(3-Methyl-2-oxo-2,3-dihydro-1H-benzo[d]imidazol-1-yl)propanoic acid, 3-(3-methyl-2-oxo-2,3-dihydro-1H-1,3-benzodiazol-1-yl)propanoic acid
| Molecular Formula | C11H12N2O3 |
|---|---|
| Molecular Weight | 220.08 g/mol |
| LogP | 1.0 |
| Topological Polar Surface Area | 60.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 220.0848 |
| Heavy Atoms | 16 |
| Complexity | 306.0 |
Chemical Identifiers
| CAS Number | 75655-45-7 |
|---|---|
| SMILES | CN1C2=CC=CC=C2N(C1=O)CCC(=O)O |
| InChIKey | GKRUPQCGSGTQDB-UHFFFAOYSA-N |
Product Overview
2,3-Dihydro-3-methyl-2-oxo-1H-benzimidazole-1-propanoic acid (CAS 75655-45-7), with molecular formula C11H12N2O3 and molecular weight 220.08 g/mol. IUPAC: 3-(3-methyl-2-oxobenzimidazol-1-yl)propanoic acid.
Chemical Property Profile of 2,3-Dihydro-3-methyl-2-oxo-1H-benzimidazole-1-propanoic acid
Property Insights of 2,3-Dihydro-3-methyl-2-oxo-1H-benzimidazole-1-propanoic acid
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,3-Dihydro-3-methyl-2-oxo-1H-benzimidazole-1-propanoic acid. The TPSA of 60.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,3-Dihydro-3-methyl-2-oxo-1H-benzimidazole-1-propanoic acid. Following Lipinski's Rule of Five, 2,3-Dihydro-3-methyl-2-oxo-1H-benzimidazole-1-propanoic acid has 1 hydrogen bond donor(s) and 3 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 2,3-Dihydro-3-methyl-2-oxo-1H-benzimidazole-1-propanoic acid?
The CAS number of 2,3-Dihydro-3-methyl-2-oxo-1H-benzimidazole-1-propanoic acid is 75655-45-7.
What is the molecular formula of 2,3-Dihydro-3-methyl-2-oxo-1H-benzimidazole-1-propanoic acid?
The molecular formula of 2,3-Dihydro-3-methyl-2-oxo-1H-benzimidazole-1-propanoic acid is C11H12N2O3.
What is the molecular weight of 2,3-Dihydro-3-methyl-2-oxo-1H-benzimidazole-1-propanoic acid?
The molecular weight of 2,3-Dihydro-3-methyl-2-oxo-1H-benzimidazole-1-propanoic acid is 220.08 g/mol.
Where can I buy 2,3-Dihydro-3-methyl-2-oxo-1H-benzimidazole-1-propanoic acid?
You can request a quote for 2,3-Dihydro-3-methyl-2-oxo-1H-benzimidazole-1-propanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,3-Dihydro-3-methyl-2-oxo-1H-benzimidazole-1-propanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 2,3-Dihydro-3-methyl-2-oxo-1H-benzimidazole-1-propanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.