1H-Indole-3-propanoic acid, 2-(ethoxycarbonyl)-
TL;DR: 1H-Indole-3-propanoic acid, 2-(ethoxycarbonyl)- (CAS 63158-58-7) is a chemical compound with molecular formula C14H15NO4 and molecular weight 261.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(2-ethoxycarbonyl-1H-indol-3-yl)propanoic acid
Also Known As: 1H-Indole-3-propanoic acid, 2-(ethoxycarbonyl)-, 3-(2-(Ethoxycarbonyl)-1H-indol-3-yl)propanoic acid, 3-(2-Ethoxycarbonylindol-3-yl)propionsaeure, 3-(2-ethoxycarbonyl-1H-indol-3-yl)propanoic Acid, 3-[2-(ethoxycarbonyl)-1H-indol-3-yl]propanoic acid
| Molecular Formula | C14H15NO4 |
|---|---|
| Molecular Weight | 261.10 g/mol |
| LogP | 2.3618 |
| Topological Polar Surface Area | 79.39 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 261.1001 |
| Heavy Atoms | 19 |
| Complexity | 614.93353 |
Chemical Identifiers
| CAS Number | 63158-58-7 |
|---|---|
| SMILES | CCOC(=O)C1=C(C2=CC=CC=C2N1)CCC(=O)O |
Product Overview
1H-Indole-3-propanoic acid, 2-(ethoxycarbonyl)- (CAS 63158-58-7), with molecular formula C14H15NO4 and molecular weight 261.10 g/mol. IUPAC: 3-(2-ethoxycarbonyl-1H-indol-3-yl)propanoic acid.
Chemical Property Profile of 1H-Indole-3-propanoic acid, 2-(ethoxycarbonyl)-
Property Insights of 1H-Indole-3-propanoic acid, 2-(ethoxycarbonyl)-
The XLogP value of 2.3618 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1H-Indole-3-propanoic acid, 2-(ethoxycarbonyl)-. The TPSA of 79.39 Ų falls within the moderate polarity range, balancing permeability and solubility for 1H-Indole-3-propanoic acid, 2-(ethoxycarbonyl)-. Following Lipinski's Rule of Five, 1H-Indole-3-propanoic acid, 2-(ethoxycarbonyl)- 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 1H-Indole-3-propanoic acid, 2-(ethoxycarbonyl)-?
The CAS number of 1H-Indole-3-propanoic acid, 2-(ethoxycarbonyl)- is 63158-58-7.
What is the molecular formula of 1H-Indole-3-propanoic acid, 2-(ethoxycarbonyl)-?
The molecular formula of 1H-Indole-3-propanoic acid, 2-(ethoxycarbonyl)- is C14H15NO4.
What is the molecular weight of 1H-Indole-3-propanoic acid, 2-(ethoxycarbonyl)-?
The molecular weight of 1H-Indole-3-propanoic acid, 2-(ethoxycarbonyl)- is 261.10 g/mol.
Where can I buy 1H-Indole-3-propanoic acid, 2-(ethoxycarbonyl)-?
You can request a quote for 1H-Indole-3-propanoic acid, 2-(ethoxycarbonyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1H-Indole-3-propanoic acid, 2-(ethoxycarbonyl)-?
Yes, KEHONG BIO provides custom synthesis services for 1H-Indole-3-propanoic acid, 2-(ethoxycarbonyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.