5-Amidinoindole
TL;DR: 5-Amidinoindole (CAS 71889-75-3) is a chemical compound with molecular formula C9H9N3 and molecular weight 159.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1H-indole-5-carboximidamide
Also Known As: 1H-Indole-5-carboximidamide, 1H-Indole-5-carboxamidine, 5-Amidinoindole, 1H-Indole-5-carboximidamide (9CI), 3-fluoro-5-(trifluoromethyl)acetophenone
| Molecular Formula | C9H9N3 |
|---|---|
| Molecular Weight | 159.08 g/mol |
| LogP | 1.0 |
| Topological Polar Surface Area | 65.7 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 159.07965 |
| Heavy Atoms | 12 |
| Complexity | 190.0 |
Chemical Identifiers
| CAS Number | 71889-75-3 |
|---|---|
| SMILES | C1=CC2=C(C=CN2)C=C1C(=N)N |
| InChIKey | DAUPWONEWDTPEP-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
5-Amidinoindole (CAS 71889-75-3), with molecular formula C9H9N3 and molecular weight 159.08 g/mol. IUPAC: 1H-indole-5-carboximidamide.
Chemical Property Profile of 5-Amidinoindole
Property Insights of 5-Amidinoindole
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Amidinoindole. The TPSA of 65.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-Amidinoindole. Following Lipinski's Rule of Five, 5-Amidinoindole has 3 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 5-Amidinoindole?
The CAS number of 5-Amidinoindole is 71889-75-3.
What is the molecular formula of 5-Amidinoindole?
The molecular formula of 5-Amidinoindole is C9H9N3.
What is the molecular weight of 5-Amidinoindole?
The molecular weight of 5-Amidinoindole is 159.08 g/mol.
Where can I buy 5-Amidinoindole?
You can request a quote for 5-Amidinoindole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Amidinoindole?
Yes, KEHONG BIO provides custom synthesis services for 5-Amidinoindole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.