1H-Indole, 1-methyl-3-(2-(4-pyridinyl)ethyl)-, hydrochloride (1:1)
TL;DR: 1H-Indole, 1-methyl-3-(2-(4-pyridinyl)ethyl)-, hydrochloride (1:1) (CAS 7770-47-0) is a chemical compound with molecular formula C16H17ClN2 and molecular weight 272.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-methyl-3-(2-pyridin-1-ium-4-ylethyl)indole chloride
Also Known As: USAF IN-399, IN 399, 4-(N-Methyl-3-indolylethyl)pyridinium hydrochloride, 1-methyl-3-(2-pyridin-1-ium-4-ylethyl)indole chloride, 4-(1-Methyl-3-indolylethyl)pyridine hydrochloride
| Molecular Formula | C16H17ClN2 |
|---|---|
| Molecular Weight | 272.11 g/mol |
| LogP | -0.22 |
| Topological Polar Surface Area | 19.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 272.10803 |
| Heavy Atoms | 19 |
| Complexity | 260.0 |
Chemical Identifiers
| CAS Number | 7770-47-0 |
|---|---|
| SMILES | CN1C=C(C2=CC=CC=C21)CCC3=CC=[NH+]C=C3.[Cl-] |
| InChIKey | CWOQYYCUEXUCCM-UHFFFAOYSA-N |
Product Overview
1H-Indole, 1-methyl-3-(2-(4-pyridinyl)ethyl)-, hydrochloride (1:1) (CAS 7770-47-0), with molecular formula C16H17ClN2 and molecular weight 272.11 g/mol. IUPAC: 1-methyl-3-(2-pyridin-1-ium-4-ylethyl)indole chloride.
Chemical Property Profile of 1H-Indole, 1-methyl-3-(2-(4-pyridinyl)ethyl)-, hydrochloride (1:1)
Property Insights of 1H-Indole, 1-methyl-3-(2-(4-pyridinyl)ethyl)-, hydrochloride (1:1)
The XLogP value of -0.22 indicates that 1H-Indole, 1-methyl-3-(2-(4-pyridinyl)ethyl)-, hydrochloride (1:1) is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 19.1 Ų, 1H-Indole, 1-methyl-3-(2-(4-pyridinyl)ethyl)-, hydrochloride (1:1) exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1H-Indole, 1-methyl-3-(2-(4-pyridinyl)ethyl)-, hydrochloride (1:1) has 1 hydrogen bond donor(s) and 1 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, 1-methyl-3-(2-(4-pyridinyl)ethyl)-, hydrochloride (1:1)?
The CAS number of 1H-Indole, 1-methyl-3-(2-(4-pyridinyl)ethyl)-, hydrochloride (1:1) is 7770-47-0.
What is the molecular formula of 1H-Indole, 1-methyl-3-(2-(4-pyridinyl)ethyl)-, hydrochloride (1:1)?
The molecular formula of 1H-Indole, 1-methyl-3-(2-(4-pyridinyl)ethyl)-, hydrochloride (1:1) is C16H17ClN2.
What is the molecular weight of 1H-Indole, 1-methyl-3-(2-(4-pyridinyl)ethyl)-, hydrochloride (1:1)?
The molecular weight of 1H-Indole, 1-methyl-3-(2-(4-pyridinyl)ethyl)-, hydrochloride (1:1) is 272.11 g/mol.
Where can I buy 1H-Indole, 1-methyl-3-(2-(4-pyridinyl)ethyl)-, hydrochloride (1:1)?
You can request a quote for 1H-Indole, 1-methyl-3-(2-(4-pyridinyl)ethyl)-, hydrochloride (1:1) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1H-Indole, 1-methyl-3-(2-(4-pyridinyl)ethyl)-, hydrochloride (1:1)?
Yes, KEHONG BIO provides custom synthesis services for 1H-Indole, 1-methyl-3-(2-(4-pyridinyl)ethyl)-, hydrochloride (1:1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.