2-(3-ethyl-2-oxo-2,3-dihydro-1H-1,3-benzodiazol-1-yl)acetic acid
TL;DR: 2-(3-ethyl-2-oxo-2,3-dihydro-1H-1,3-benzodiazol-1-yl)acetic acid (CAS 406944-97-6) 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.
2-(3-ethyl-2-oxobenzimidazol-1-yl)acetic acid
Also Known As: 2-(3-ethyl-2-oxo-2,3-dihydro-1H-1,3-benzodiazol-1-yl)acetic acid, (3-ethyl-2-oxo-2,3-dihydro-1H-benzimidazol-1-yl)acetic acid, 2-(3-ethyl-2-oxobenzimidazol-1-yl)acetic acid, 2-(3-Ethyl-2-oxo-2,3-dihydro-1H-benzo[d]imidazol-1-yl)acetic acid, 2-(3-ethyl-2-oxo-benzoimidazol-1-yl)acetic Acid
| Molecular Formula | C11H12N2O3 |
|---|---|
| Molecular Weight | 220.08 g/mol |
| LogP | 0.9075 |
| Topological Polar Surface Area | 64.23 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 220.0848 |
| Heavy Atoms | 16 |
| Complexity | 594.78577 |
Chemical Identifiers
| CAS Number | 406944-97-6 |
|---|---|
| SMILES | CCN1C2=CC=CC=C2N(C1=O)CC(=O)O |
Product Overview
2-(3-ethyl-2-oxo-2,3-dihydro-1H-1,3-benzodiazol-1-yl)acetic acid (CAS 406944-97-6), with molecular formula C11H12N2O3 and molecular weight 220.08 g/mol. IUPAC: 2-(3-ethyl-2-oxobenzimidazol-1-yl)acetic acid.
Chemical Property Profile of 2-(3-ethyl-2-oxo-2,3-dihydro-1H-1,3-benzodiazol-1-yl)acetic acid
Property Insights of 2-(3-ethyl-2-oxo-2,3-dihydro-1H-1,3-benzodiazol-1-yl)acetic acid
The XLogP value of 0.9075 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(3-ethyl-2-oxo-2,3-dihydro-1H-1,3-benzodiazol-1-yl)acetic acid. The TPSA of 64.23 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(3-ethyl-2-oxo-2,3-dihydro-1H-1,3-benzodiazol-1-yl)acetic acid. Following Lipinski's Rule of Five, 2-(3-ethyl-2-oxo-2,3-dihydro-1H-1,3-benzodiazol-1-yl)acetic 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 2-(3-ethyl-2-oxo-2,3-dihydro-1H-1,3-benzodiazol-1-yl)acetic acid?
The CAS number of 2-(3-ethyl-2-oxo-2,3-dihydro-1H-1,3-benzodiazol-1-yl)acetic acid is 406944-97-6.
What is the molecular formula of 2-(3-ethyl-2-oxo-2,3-dihydro-1H-1,3-benzodiazol-1-yl)acetic acid?
The molecular formula of 2-(3-ethyl-2-oxo-2,3-dihydro-1H-1,3-benzodiazol-1-yl)acetic acid is C11H12N2O3.
What is the molecular weight of 2-(3-ethyl-2-oxo-2,3-dihydro-1H-1,3-benzodiazol-1-yl)acetic acid?
The molecular weight of 2-(3-ethyl-2-oxo-2,3-dihydro-1H-1,3-benzodiazol-1-yl)acetic acid is 220.08 g/mol.
Where can I buy 2-(3-ethyl-2-oxo-2,3-dihydro-1H-1,3-benzodiazol-1-yl)acetic acid?
You can request a quote for 2-(3-ethyl-2-oxo-2,3-dihydro-1H-1,3-benzodiazol-1-yl)acetic 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-ethyl-2-oxo-2,3-dihydro-1H-1,3-benzodiazol-1-yl)acetic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-(3-ethyl-2-oxo-2,3-dihydro-1H-1,3-benzodiazol-1-yl)acetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.