Indole, 3-(2-methylaminopropyl)-5-methylthio-
TL;DR: Indole, 3-(2-methylaminopropyl)-5-methylthio- (CAS 5102-12-5) is a chemical compound with molecular formula C13H18N2S and molecular weight 234.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-methyl-1-(5-methylsulfanyl-1H-indol-3-yl)propan-2-amine
Also Known As: 5-Methylthio-3-(2-methylaminopropyl)indole, INDOLE, 3-(2-METHYLAMINOPROPYL)-5-METHYLTHIO-, 5-22-12-00086 (Beilstein Handbook Reference), N-methyl-1-(5-methylsulfanyl-1H-indol-3-yl)propan-2-amine, N-methyl-1-[5-(methylsulfanyl)-1H-indol-3-yl]propan-2-amine
| Molecular Formula | C13H18N2S |
|---|---|
| Molecular Weight | 234.12 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 53.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 234.11906 |
| Heavy Atoms | 16 |
| Complexity | 222.0 |
Chemical Identifiers
| CAS Number | 5102-12-5 |
|---|---|
| SMILES | CC(CC1=CNC2=C1C=C(C=C2)SC)NC |
| InChIKey | BQBRWLOYDUVQLW-UHFFFAOYSA-N |
Product Overview
Indole, 3-(2-methylaminopropyl)-5-methylthio- (CAS 5102-12-5), with molecular formula C13H18N2S and molecular weight 234.12 g/mol. IUPAC: N-methyl-1-(5-methylsulfanyl-1H-indol-3-yl)propan-2-amine.
Chemical Property Profile of Indole, 3-(2-methylaminopropyl)-5-methylthio-
Property Insights of Indole, 3-(2-methylaminopropyl)-5-methylthio-
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Indole, 3-(2-methylaminopropyl)-5-methylthio-. With a topological polar surface area (TPSA) of 53.1 Ų, Indole, 3-(2-methylaminopropyl)-5-methylthio- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Indole, 3-(2-methylaminopropyl)-5-methylthio- has 2 hydrogen bond donor(s) and 2 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-methylaminopropyl)-5-methylthio-?
The CAS number of Indole, 3-(2-methylaminopropyl)-5-methylthio- is 5102-12-5.
What is the molecular formula of Indole, 3-(2-methylaminopropyl)-5-methylthio-?
The molecular formula of Indole, 3-(2-methylaminopropyl)-5-methylthio- is C13H18N2S.
What is the molecular weight of Indole, 3-(2-methylaminopropyl)-5-methylthio-?
The molecular weight of Indole, 3-(2-methylaminopropyl)-5-methylthio- is 234.12 g/mol.
Where can I buy Indole, 3-(2-methylaminopropyl)-5-methylthio-?
You can request a quote for Indole, 3-(2-methylaminopropyl)-5-methylthio- 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-methylaminopropyl)-5-methylthio-?
Yes, KEHONG BIO provides custom synthesis services for Indole, 3-(2-methylaminopropyl)-5-methylthio- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.