Indole, 3-(2-aminobutyl)-4-chloro-
TL;DR: Indole, 3-(2-aminobutyl)-4-chloro- (CAS 715-47-9) is a chemical compound with molecular formula C12H15ClN2 and molecular weight 222.09 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-amine
Also Known As: 3-(2-Aminobutyl)-4-chloroindole, 1-(4-chloro-1H-indol-3-yl)butan-2-amine, 4-Chloro-3-(alpha-ethylaminoethyl) indole, INDOLE, 3-(2-AMINOBUTYL)-4-CHLORO-, 1-(4-chloro-indol-3-ylmethyl)-propylamine
| Molecular Formula | C12H15ClN2 |
|---|---|
| Molecular Weight | 222.09 g/mol |
| LogP | 3.0 |
| Topological Polar Surface Area | 41.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 222.09238 |
| Heavy Atoms | 15 |
| Complexity | 210.0 |
Chemical Identifiers
| CAS Number | 715-47-9 |
|---|---|
| SMILES | CCC(CC1=CNC2=C1C(=CC=C2)Cl)N |
| InChIKey | YAYYLLZJMZNDFN-UHFFFAOYSA-N |
Product Overview
Indole, 3-(2-aminobutyl)-4-chloro- (CAS 715-47-9), with molecular formula C12H15ClN2 and molecular weight 222.09 g/mol. IUPAC: 1-(4-chloro-1H-indol-3-yl)butan-2-amine.
Chemical Property Profile of Indole, 3-(2-aminobutyl)-4-chloro-
Property Insights of Indole, 3-(2-aminobutyl)-4-chloro-
The XLogP value of 3.0 indicates that Indole, 3-(2-aminobutyl)-4-chloro- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 41.8 Ų, Indole, 3-(2-aminobutyl)-4-chloro- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Indole, 3-(2-aminobutyl)-4-chloro- 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 Indole, 3-(2-aminobutyl)-4-chloro-?
The CAS number of Indole, 3-(2-aminobutyl)-4-chloro- is 715-47-9.
What is the molecular formula of Indole, 3-(2-aminobutyl)-4-chloro-?
The molecular formula of Indole, 3-(2-aminobutyl)-4-chloro- is C12H15ClN2.
What is the molecular weight of Indole, 3-(2-aminobutyl)-4-chloro-?
The molecular weight of Indole, 3-(2-aminobutyl)-4-chloro- is 222.09 g/mol.
Where can I buy Indole, 3-(2-aminobutyl)-4-chloro-?
You can request a quote for Indole, 3-(2-aminobutyl)-4-chloro- 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-aminobutyl)-4-chloro-?
Yes, KEHONG BIO provides custom synthesis services for Indole, 3-(2-aminobutyl)-4-chloro- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.