Propanethiol, 2-((3-aminopropyl)amino)-, hydrogen sulfate (ester), hydrochloride
TL;DR: Propanethiol, 2-((3-aminopropyl)amino)-, hydrogen sulfate (ester), hydrochloride (CAS 23545-59-7) is a chemical compound with molecular formula C6H17ClN2O3S2 and molecular weight 264.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(3-aminopropylamino)-1-sulfosulfanylpropane;hydrochloride
Also Known As: S-2-((3-Aminopropyl)amino)propyl hydrogen thiosulfate hydrochloride, 2-(3-aminopropylamino)-1-sulfosulfanylpropane hydrochloride, Propanethiol, 2-((3-aminopropyl)amino)-, hydrogen sulfate (ester), hydrochloride, s-{2-[(3-aminopropyl)amino]propyl} hydrogen sulfurothioate hydrochloride(1:1), S-{2-[(3-Aminopropyl)amino]propyl} hydrogen sulfurothioate--hydrogen chloride (1/1)
| Molecular Formula | C6H17ClN2O3S2 |
|---|---|
| Molecular Weight | 264.04 g/mol |
| LogP | 0.27 |
| Topological Polar Surface Area | 126.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 264.03693 |
| Heavy Atoms | 14 |
| Complexity | 212.0 |
Chemical Identifiers
| CAS Number | 23545-59-7 |
|---|---|
| SMILES | CC(CSS(=O)(=O)O)NCCCN.Cl |
| InChIKey | DFBNXHDETSPXEW-UHFFFAOYSA-N |
Product Overview
Propanethiol, 2-((3-aminopropyl)amino)-, hydrogen sulfate (ester), hydrochloride (CAS 23545-59-7), with molecular formula C6H17ClN2O3S2 and molecular weight 264.04 g/mol. IUPAC: 2-(3-aminopropylamino)-1-sulfosulfanylpropane;hydrochloride.
Chemical Property Profile of Propanethiol, 2-((3-aminopropyl)amino)-, hydrogen sulfate (ester), hydrochloride
Property Insights of Propanethiol, 2-((3-aminopropyl)amino)-, hydrogen sulfate (ester), hydrochloride
The XLogP value of 0.27 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Propanethiol, 2-((3-aminopropyl)amino)-, hydrogen sulfate (ester), hydrochloride. The TPSA of 126.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Propanethiol, 2-((3-aminopropyl)amino)-, hydrogen sulfate (ester), hydrochloride. Following Lipinski's Rule of Five, Propanethiol, 2-((3-aminopropyl)amino)-, hydrogen sulfate (ester), hydrochloride has 4 hydrogen bond donor(s) and 6 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 Propanethiol, 2-((3-aminopropyl)amino)-, hydrogen sulfate (ester), hydrochloride?
The CAS number of Propanethiol, 2-((3-aminopropyl)amino)-, hydrogen sulfate (ester), hydrochloride is 23545-59-7.
What is the molecular formula of Propanethiol, 2-((3-aminopropyl)amino)-, hydrogen sulfate (ester), hydrochloride?
The molecular formula of Propanethiol, 2-((3-aminopropyl)amino)-, hydrogen sulfate (ester), hydrochloride is C6H17ClN2O3S2.
What is the molecular weight of Propanethiol, 2-((3-aminopropyl)amino)-, hydrogen sulfate (ester), hydrochloride?
The molecular weight of Propanethiol, 2-((3-aminopropyl)amino)-, hydrogen sulfate (ester), hydrochloride is 264.04 g/mol.
Where can I buy Propanethiol, 2-((3-aminopropyl)amino)-, hydrogen sulfate (ester), hydrochloride?
You can request a quote for Propanethiol, 2-((3-aminopropyl)amino)-, hydrogen sulfate (ester), hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Propanethiol, 2-((3-aminopropyl)amino)-, hydrogen sulfate (ester), hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Propanethiol, 2-((3-aminopropyl)amino)-, hydrogen sulfate (ester), hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.