3-(2-oxo-2,3-dihydro-1H-indol-3-yl)propanoic acid
TL;DR: 3-(2-oxo-2,3-dihydro-1H-indol-3-yl)propanoic acid (CAS 2971-17-7) is a chemical compound with molecular formula C11H11NO3 and molecular weight 205.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(2-oxo-1,3-dihydroindol-3-yl)propanoic acid
Also Known As: 3-(2-Oxoindolin-3-yl)propanoic acid, 3-(2-Oxo-2,3-dihydro-1H-indol-3-yl)propanoic acid, 3-(2-oxo-1,3-dihydroindol-3-yl)propanoic acid, 1H-Indole-3-propanoic acid, 2,3-dihydro-2-oxo-, 3-(2-Oxoindolin-3-yl)propanoicacid
| Molecular Formula | C11H11NO3 |
|---|---|
| Molecular Weight | 205.07 g/mol |
| LogP | 0.7 |
| Topological Polar Surface Area | 66.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 205.0739 |
| Heavy Atoms | 15 |
| Complexity | 277.0 |
Chemical Identifiers
| CAS Number | 2971-17-7 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(C(=O)N2)CCC(=O)O |
| InChIKey | BFQGSVVUAHHSFU-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-(2-oxo-2,3-dihydro-1H-indol-3-yl)propanoic acid (CAS 2971-17-7), with molecular formula C11H11NO3 and molecular weight 205.07 g/mol. IUPAC: 3-(2-oxo-1,3-dihydroindol-3-yl)propanoic acid.
Chemical Property Profile of 3-(2-oxo-2,3-dihydro-1H-indol-3-yl)propanoic acid
Property Insights of 3-(2-oxo-2,3-dihydro-1H-indol-3-yl)propanoic acid
The XLogP value of 0.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(2-oxo-2,3-dihydro-1H-indol-3-yl)propanoic acid. The TPSA of 66.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(2-oxo-2,3-dihydro-1H-indol-3-yl)propanoic acid. Following Lipinski's Rule of Five, 3-(2-oxo-2,3-dihydro-1H-indol-3-yl)propanoic acid has 2 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 3-(2-oxo-2,3-dihydro-1H-indol-3-yl)propanoic acid?
The CAS number of 3-(2-oxo-2,3-dihydro-1H-indol-3-yl)propanoic acid is 2971-17-7.
What is the molecular formula of 3-(2-oxo-2,3-dihydro-1H-indol-3-yl)propanoic acid?
The molecular formula of 3-(2-oxo-2,3-dihydro-1H-indol-3-yl)propanoic acid is C11H11NO3.
What is the molecular weight of 3-(2-oxo-2,3-dihydro-1H-indol-3-yl)propanoic acid?
The molecular weight of 3-(2-oxo-2,3-dihydro-1H-indol-3-yl)propanoic acid is 205.07 g/mol.
Where can I buy 3-(2-oxo-2,3-dihydro-1H-indol-3-yl)propanoic acid?
You can request a quote for 3-(2-oxo-2,3-dihydro-1H-indol-3-yl)propanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(2-oxo-2,3-dihydro-1H-indol-3-yl)propanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-(2-oxo-2,3-dihydro-1H-indol-3-yl)propanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.