Ethanethiol, 2-((3-((4-aminobutyl)amino)propyl)amino)-
TL;DR: Ethanethiol, 2-((3-((4-aminobutyl)amino)propyl)amino)- (CAS 45112-10-5) is a chemical compound with molecular formula C9H23N3S and molecular weight 205.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[3-(4-aminobutylamino)propylamino]ethanethiol
Also Known As: 2-[3- propylamino]ethanethiol, WR 35980, 2-[3-(4-aminobutylamino)propylamino]ethanethiol, 5,6-diphenyl-1,2,4-triazine-3-amine, Ethanethiol, 2-((3-((4-aminobutyl)amino)propyl)amino)-
| Molecular Formula | C9H23N3S |
|---|---|
| Molecular Weight | 205.16 g/mol |
| LogP | -0.2 |
| Topological Polar Surface Area | 51.1 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 10 |
| Exact Mass | 205.16127 |
| Heavy Atoms | 13 |
| Complexity | 90.0 |
Chemical Identifiers
| CAS Number | 45112-10-5 |
|---|---|
| SMILES | C(CCNCCCNCCS)CN |
| InChIKey | ASAYMENCPKWYPG-UHFFFAOYSA-N |
Product Overview
Ethanethiol, 2-((3-((4-aminobutyl)amino)propyl)amino)- (CAS 45112-10-5), with molecular formula C9H23N3S and molecular weight 205.16 g/mol. IUPAC: 2-[3-(4-aminobutylamino)propylamino]ethanethiol.
Chemical Property Profile of Ethanethiol, 2-((3-((4-aminobutyl)amino)propyl)amino)-
Property Insights of Ethanethiol, 2-((3-((4-aminobutyl)amino)propyl)amino)-
The XLogP value of -0.2 indicates that Ethanethiol, 2-((3-((4-aminobutyl)amino)propyl)amino)- is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 51.1 Ų, Ethanethiol, 2-((3-((4-aminobutyl)amino)propyl)amino)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethanethiol, 2-((3-((4-aminobutyl)amino)propyl)amino)- has 4 hydrogen bond donor(s) and 4 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 Ethanethiol, 2-((3-((4-aminobutyl)amino)propyl)amino)-?
The CAS number of Ethanethiol, 2-((3-((4-aminobutyl)amino)propyl)amino)- is 45112-10-5.
What is the molecular formula of Ethanethiol, 2-((3-((4-aminobutyl)amino)propyl)amino)-?
The molecular formula of Ethanethiol, 2-((3-((4-aminobutyl)amino)propyl)amino)- is C9H23N3S.
What is the molecular weight of Ethanethiol, 2-((3-((4-aminobutyl)amino)propyl)amino)-?
The molecular weight of Ethanethiol, 2-((3-((4-aminobutyl)amino)propyl)amino)- is 205.16 g/mol.
Where can I buy Ethanethiol, 2-((3-((4-aminobutyl)amino)propyl)amino)-?
You can request a quote for Ethanethiol, 2-((3-((4-aminobutyl)amino)propyl)amino)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethanethiol, 2-((3-((4-aminobutyl)amino)propyl)amino)-?
Yes, KEHONG BIO provides custom synthesis services for Ethanethiol, 2-((3-((4-aminobutyl)amino)propyl)amino)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.