Indole, 3-(2-pyridylmethyl)-
TL;DR: Indole, 3-(2-pyridylmethyl)- (CAS 5580-44-9) is a chemical compound with molecular formula C14H12N2 and molecular weight 208.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(pyridin-2-ylmethyl)-1H-indole
Also Known As: 3-(2-Pyridylmethyl)indole, INDOLE, 3-(2-PYRIDYLMETHYL)-, 3-(pyridin-2-ylmethyl)-1H-indole, 3-(2-Pyridylmethyl)-1H-indole, 3-Pyridin-2-ylmethyl-1H-indole
| Molecular Formula | C14H12N2 |
|---|---|
| Molecular Weight | 208.10 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 28.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 208.10005 |
| Heavy Atoms | 16 |
| Complexity | 229.0 |
Chemical Identifiers
| CAS Number | 5580-44-9 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=CN2)CC3=CC=CC=N3 |
| InChIKey | REMGZSGXONUDEF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Indole, 3-(2-pyridylmethyl)- (CAS 5580-44-9), with molecular formula C14H12N2 and molecular weight 208.10 g/mol. IUPAC: 3-(pyridin-2-ylmethyl)-1H-indole.
Chemical Property Profile of Indole, 3-(2-pyridylmethyl)-
Property Insights of Indole, 3-(2-pyridylmethyl)-
The XLogP value of 3.1 indicates that Indole, 3-(2-pyridylmethyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 28.7 Ų, Indole, 3-(2-pyridylmethyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Indole, 3-(2-pyridylmethyl)- 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 Indole, 3-(2-pyridylmethyl)-?
The CAS number of Indole, 3-(2-pyridylmethyl)- is 5580-44-9.
What is the molecular formula of Indole, 3-(2-pyridylmethyl)-?
The molecular formula of Indole, 3-(2-pyridylmethyl)- is C14H12N2.
What is the molecular weight of Indole, 3-(2-pyridylmethyl)-?
The molecular weight of Indole, 3-(2-pyridylmethyl)- is 208.10 g/mol.
Where can I buy Indole, 3-(2-pyridylmethyl)-?
You can request a quote for Indole, 3-(2-pyridylmethyl)- 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-pyridylmethyl)-?
Yes, KEHONG BIO provides custom synthesis services for Indole, 3-(2-pyridylmethyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.