3-(5-Chloro-7-fluoro-3-indolyl)-1-propanamine
TL;DR: 3-(5-Chloro-7-fluoro-3-indolyl)-1-propanamine (CAS 586336-13-2) is a chemical compound with molecular formula C11H12ClFN2 and molecular weight 226.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(5-chloro-7-fluoro-1H-indol-3-yl)propan-1-amine
Also Known As: 3-(5-chloro-7-fluoro-1H-indol-3-yl)propan-1-amine, 3-(5-Chloro-7-fluoro-3-indolyl)-1-propanamine
| Molecular Formula | C11H12ClFN2 |
|---|---|
| Molecular Weight | 226.07 g/mol |
| LogP | 2.8517 |
| Topological Polar Surface Area | 41.81 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 226.0673 |
| Heavy Atoms | 15 |
| Complexity | 478.63782 |
Chemical Identifiers
| CAS Number | 586336-13-2 |
|---|---|
| SMILES | C1=C(C=C(C2=C1C(=CN2)CCCN)F)Cl |
Product Overview
3-(5-Chloro-7-fluoro-3-indolyl)-1-propanamine (CAS 586336-13-2), with molecular formula C11H12ClFN2 and molecular weight 226.07 g/mol. IUPAC: 3-(5-chloro-7-fluoro-1H-indol-3-yl)propan-1-amine.
Chemical Property Profile of 3-(5-Chloro-7-fluoro-3-indolyl)-1-propanamine
Property Insights of 3-(5-Chloro-7-fluoro-3-indolyl)-1-propanamine
The XLogP value of 2.8517 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(5-Chloro-7-fluoro-3-indolyl)-1-propanamine. With a topological polar surface area (TPSA) of 41.81 Ų, 3-(5-Chloro-7-fluoro-3-indolyl)-1-propanamine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(5-Chloro-7-fluoro-3-indolyl)-1-propanamine has 2 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 3-(5-Chloro-7-fluoro-3-indolyl)-1-propanamine?
The CAS number of 3-(5-Chloro-7-fluoro-3-indolyl)-1-propanamine is 586336-13-2.
What is the molecular formula of 3-(5-Chloro-7-fluoro-3-indolyl)-1-propanamine?
The molecular formula of 3-(5-Chloro-7-fluoro-3-indolyl)-1-propanamine is C11H12ClFN2.
What is the molecular weight of 3-(5-Chloro-7-fluoro-3-indolyl)-1-propanamine?
The molecular weight of 3-(5-Chloro-7-fluoro-3-indolyl)-1-propanamine is 226.07 g/mol.
Where can I buy 3-(5-Chloro-7-fluoro-3-indolyl)-1-propanamine?
You can request a quote for 3-(5-Chloro-7-fluoro-3-indolyl)-1-propanamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(5-Chloro-7-fluoro-3-indolyl)-1-propanamine?
Yes, KEHONG BIO provides custom synthesis services for 3-(5-Chloro-7-fluoro-3-indolyl)-1-propanamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.