1-(1H-indol-3-yl)butan-2-ylazanium acetate
TL;DR: 1-(1H-indol-3-yl)butan-2-ylazanium acetate (CAS 14030-13-8) is a chemical compound with molecular formula C14H20N2O2 and molecular weight 248.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(1H-indol-3-yl)butan-2-ylazanium acetate
Also Known As: (+)-Etryptamine acetate, d-alpha-Ethyltryptamine acetate, d-3-(2-Aminobutyl)indole, acetate, l-3-(2-Aminobutyl)indole acetate, etryptamine monoacetate, (+)-isomer
| Molecular Formula | C14H20N2O2 |
|---|---|
| Molecular Weight | 248.15 g/mol |
| LogP | 0.49 |
| Topological Polar Surface Area | 79.1 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 248.15248 |
| Heavy Atoms | 18 |
| Complexity | 212.0 |
Chemical Identifiers
| CAS Number | 14030-13-8 |
|---|---|
| SMILES | CCC(CC1=CNC2=CC=CC=C21)[NH3+].CC(=O)[O-] |
| InChIKey | TUQLBJAHRWROHB-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-(1H-indol-3-yl)butan-2-ylazanium acetate (CAS 14030-13-8), with molecular formula C14H20N2O2 and molecular weight 248.15 g/mol. IUPAC: 1-(1H-indol-3-yl)butan-2-ylazanium acetate.
Chemical Property Profile of 1-(1H-indol-3-yl)butan-2-ylazanium acetate
Property Insights of 1-(1H-indol-3-yl)butan-2-ylazanium acetate
The XLogP value of 0.49 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(1H-indol-3-yl)butan-2-ylazanium acetate. The TPSA of 79.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(1H-indol-3-yl)butan-2-ylazanium acetate. Following Lipinski's Rule of Five, 1-(1H-indol-3-yl)butan-2-ylazanium acetate has 3 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 1-(1H-indol-3-yl)butan-2-ylazanium acetate?
The CAS number of 1-(1H-indol-3-yl)butan-2-ylazanium acetate is 14030-13-8.
What is the molecular formula of 1-(1H-indol-3-yl)butan-2-ylazanium acetate?
The molecular formula of 1-(1H-indol-3-yl)butan-2-ylazanium acetate is C14H20N2O2.
What is the molecular weight of 1-(1H-indol-3-yl)butan-2-ylazanium acetate?
The molecular weight of 1-(1H-indol-3-yl)butan-2-ylazanium acetate is 248.15 g/mol.
Where can I buy 1-(1H-indol-3-yl)butan-2-ylazanium acetate?
You can request a quote for 1-(1H-indol-3-yl)butan-2-ylazanium acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(1H-indol-3-yl)butan-2-ylazanium acetate?
Yes, KEHONG BIO provides custom synthesis services for 1-(1H-indol-3-yl)butan-2-ylazanium acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.