1-(4-Chloro-1H-indol-3-yl)butan-2-amine--hydrogen chloride (1/1)
TL;DR: 1-(4-Chloro-1H-indol-3-yl)butan-2-amine--hydrogen chloride (1/1) (CAS 1206-72-0) is a chemical compound with molecular formula C12H16Cl2N2 and molecular weight 258.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-chloro-1H-indol-3-yl)butan-2-ylazanium chloride
Also Known As: 3-(2-Aminobutyl)-4-chloroindole hydrochloride, 1-(4-chloro-1H-indol-3-yl)butan-2-ylazanium chloride, 1-(4-chloro-1H-indol-3-yl)butan-2-ylazanium, INDOLE, 3-(2-AMINOBUTYL)-4-CHLORO-, HYDROCHLORIDE, 1-(4-Chloro-1H-indol-3-yl)butan-2-amine--hydrogen chloride (1/1)
| Molecular Formula | C12H16Cl2N2 |
|---|---|
| Molecular Weight | 258.07 g/mol |
| LogP | -0.61 |
| Topological Polar Surface Area | 43.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 258.06906 |
| Heavy Atoms | 16 |
| Complexity | 210.0 |
Chemical Identifiers
| CAS Number | 1206-72-0 |
|---|---|
| SMILES | CCC(CC1=CNC2=C1C(=CC=C2)Cl)[NH3+].[Cl-] |
| InChIKey | VYEWZCYSAWMIPC-UHFFFAOYSA-N |
Product Overview
1-(4-Chloro-1H-indol-3-yl)butan-2-amine--hydrogen chloride (1/1) (CAS 1206-72-0), with molecular formula C12H16Cl2N2 and molecular weight 258.07 g/mol. IUPAC: 1-(4-chloro-1H-indol-3-yl)butan-2-ylazanium chloride.
Chemical Property Profile of 1-(4-Chloro-1H-indol-3-yl)butan-2-amine--hydrogen chloride (1/1)
Property Insights of 1-(4-Chloro-1H-indol-3-yl)butan-2-amine--hydrogen chloride (1/1)
The XLogP value of -0.61 indicates that 1-(4-Chloro-1H-indol-3-yl)butan-2-amine--hydrogen chloride (1/1) is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 43.4 Ų, 1-(4-Chloro-1H-indol-3-yl)butan-2-amine--hydrogen chloride (1/1) exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(4-Chloro-1H-indol-3-yl)butan-2-amine--hydrogen chloride (1/1) 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 1-(4-Chloro-1H-indol-3-yl)butan-2-amine--hydrogen chloride (1/1)?
The CAS number of 1-(4-Chloro-1H-indol-3-yl)butan-2-amine--hydrogen chloride (1/1) is 1206-72-0.
What is the molecular formula of 1-(4-Chloro-1H-indol-3-yl)butan-2-amine--hydrogen chloride (1/1)?
The molecular formula of 1-(4-Chloro-1H-indol-3-yl)butan-2-amine--hydrogen chloride (1/1) is C12H16Cl2N2.
What is the molecular weight of 1-(4-Chloro-1H-indol-3-yl)butan-2-amine--hydrogen chloride (1/1)?
The molecular weight of 1-(4-Chloro-1H-indol-3-yl)butan-2-amine--hydrogen chloride (1/1) is 258.07 g/mol.
Where can I buy 1-(4-Chloro-1H-indol-3-yl)butan-2-amine--hydrogen chloride (1/1)?
You can request a quote for 1-(4-Chloro-1H-indol-3-yl)butan-2-amine--hydrogen chloride (1/1) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(4-Chloro-1H-indol-3-yl)butan-2-amine--hydrogen chloride (1/1)?
Yes, KEHONG BIO provides custom synthesis services for 1-(4-Chloro-1H-indol-3-yl)butan-2-amine--hydrogen chloride (1/1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.