Indole, 3-(2-(2-mercaptoethyl)aminoethyl)-, hydrochloride
TL;DR: Indole, 3-(2-(2-mercaptoethyl)aminoethyl)-, hydrochloride (CAS 73816-49-6) is a chemical compound with molecular formula C12H17ClN2S and molecular weight 256.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(1H-indol-3-yl)ethyl-(2-sulfanylethyl)azanium chloride
Also Known As: 3-(2-(beta-Mercaptoethyl)amino)ethylindole hydrochloride, INDOLE, 3-(2-(2-MERCAPTOETHYL)AMINOETHYL)-, HYDROCHLORIDE, 2-(1H-indol-3-yl)ethyl-(2-sulfanylethyl)azanium chloride, Ethanethiol, 2-[[2-(1H-indol-3-yl)ethyl]amino]-, hydrochloride
| Molecular Formula | C12H17ClN2S |
|---|---|
| Molecular Weight | 256.08 g/mol |
| LogP | -1.79 |
| Topological Polar Surface Area | 33.4 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 256.0801 |
| Heavy Atoms | 16 |
| Complexity | 186.0 |
Chemical Identifiers
| CAS Number | 73816-49-6 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=CN2)CC[NH2+]CCS.[Cl-] |
| InChIKey | LTWCPTNOVUQLLT-UHFFFAOYSA-N |
Product Overview
Indole, 3-(2-(2-mercaptoethyl)aminoethyl)-, hydrochloride (CAS 73816-49-6), with molecular formula C12H17ClN2S and molecular weight 256.08 g/mol. IUPAC: 2-(1H-indol-3-yl)ethyl-(2-sulfanylethyl)azanium chloride.
Chemical Property Profile of Indole, 3-(2-(2-mercaptoethyl)aminoethyl)-, hydrochloride
Property Insights of Indole, 3-(2-(2-mercaptoethyl)aminoethyl)-, hydrochloride
The XLogP value of -1.79 indicates that Indole, 3-(2-(2-mercaptoethyl)aminoethyl)-, hydrochloride is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 33.4 Ų, Indole, 3-(2-(2-mercaptoethyl)aminoethyl)-, hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Indole, 3-(2-(2-mercaptoethyl)aminoethyl)-, hydrochloride has 3 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 Indole, 3-(2-(2-mercaptoethyl)aminoethyl)-, hydrochloride?
The CAS number of Indole, 3-(2-(2-mercaptoethyl)aminoethyl)-, hydrochloride is 73816-49-6.
What is the molecular formula of Indole, 3-(2-(2-mercaptoethyl)aminoethyl)-, hydrochloride?
The molecular formula of Indole, 3-(2-(2-mercaptoethyl)aminoethyl)-, hydrochloride is C12H17ClN2S.
What is the molecular weight of Indole, 3-(2-(2-mercaptoethyl)aminoethyl)-, hydrochloride?
The molecular weight of Indole, 3-(2-(2-mercaptoethyl)aminoethyl)-, hydrochloride is 256.08 g/mol.
Where can I buy Indole, 3-(2-(2-mercaptoethyl)aminoethyl)-, hydrochloride?
You can request a quote for Indole, 3-(2-(2-mercaptoethyl)aminoethyl)-, hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Indole, 3-(2-(2-mercaptoethyl)aminoethyl)-, hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Indole, 3-(2-(2-mercaptoethyl)aminoethyl)-, hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.