3-(2-Aminoethyl)-1H-indole-4,5,7-triol
TL;DR: 3-(2-Aminoethyl)-1H-indole-4,5,7-triol (CAS 100513-77-7) is a chemical compound with molecular formula C10H12N2O3 and molecular weight 208.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(2-aminoethyl)-1H-indole-4,5,7-triol
Also Known As: 3-(2-aminoethyl)-1H-indole-4,5,7-triol, 4,5,7-trihydroxytryptamine, 1H-INDOLE-4,5,7-TRIOL,3-(2-AMINOETHYL)-, 1H-Indole-1-carboxamide, N-(2,2-dimethyl-1-oxopropyl)-2,3-dihydro-2-oxo-3-(2-thienylcarbonyl)-, RefChem:273545
| Molecular Formula | C10H12N2O3 |
|---|---|
| Molecular Weight | 208.08 g/mol |
| LogP | 0.3 |
| Topological Polar Surface Area | 103.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 208.0848 |
| Heavy Atoms | 15 |
| Complexity | 227.0 |
Chemical Identifiers
| CAS Number | 100513-77-7 |
|---|---|
| SMILES | C1=C(C2=C(C(=CN2)CCN)C(=C1O)O)O |
| InChIKey | AKHSJVWULQDHPQ-UHFFFAOYSA-N |
Product Overview
3-(2-Aminoethyl)-1H-indole-4,5,7-triol (CAS 100513-77-7), with molecular formula C10H12N2O3 and molecular weight 208.08 g/mol. IUPAC: 3-(2-aminoethyl)-1H-indole-4,5,7-triol.
Chemical Property Profile of 3-(2-Aminoethyl)-1H-indole-4,5,7-triol
Property Insights of 3-(2-Aminoethyl)-1H-indole-4,5,7-triol
The XLogP value of 0.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(2-Aminoethyl)-1H-indole-4,5,7-triol. The TPSA of 103.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(2-Aminoethyl)-1H-indole-4,5,7-triol. Following Lipinski's Rule of Five, 3-(2-Aminoethyl)-1H-indole-4,5,7-triol has 5 hydrogen bond donor(s) and 4 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-Aminoethyl)-1H-indole-4,5,7-triol?
The CAS number of 3-(2-Aminoethyl)-1H-indole-4,5,7-triol is 100513-77-7.
What is the molecular formula of 3-(2-Aminoethyl)-1H-indole-4,5,7-triol?
The molecular formula of 3-(2-Aminoethyl)-1H-indole-4,5,7-triol is C10H12N2O3.
What is the molecular weight of 3-(2-Aminoethyl)-1H-indole-4,5,7-triol?
The molecular weight of 3-(2-Aminoethyl)-1H-indole-4,5,7-triol is 208.08 g/mol.
Where can I buy 3-(2-Aminoethyl)-1H-indole-4,5,7-triol?
You can request a quote for 3-(2-Aminoethyl)-1H-indole-4,5,7-triol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(2-Aminoethyl)-1H-indole-4,5,7-triol?
Yes, KEHONG BIO provides custom synthesis services for 3-(2-Aminoethyl)-1H-indole-4,5,7-triol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.