N,N'-Pentamethylenebis[s-3-aminopropyl thiosulfuric acid]
TL;DR: N,N'-Pentamethylenebis[s-3-aminopropyl thiosulfuric acid] (CAS 35871-54-6) is a chemical compound with molecular formula C11H26N2O6S4 and molecular weight 410.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,5-bis(3-sulfosulfanylpropylamino)pentane
Also Known As: 1,5-bis(3-sulfosulfanylpropylamino)pentane, N,N'-Pentamethylenbis(S-3-aminopropyl-hydrogen-thiosulfat), N,N'-Pentamethylenebis[s-3-aminopropyl thiosulfuric acid], S-[3-((5-[(3-([Hydroxy(dioxido)sulfanyl]sulfanyl)propyl)amino]pentyl)amino)propyl] hydrogen thiosulfate #
| Molecular Formula | C11H26N2O6S4 |
|---|---|
| Molecular Weight | 410.07 g/mol |
| LogP | -4.8 |
| Topological Polar Surface Area | 200.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 16 |
| Exact Mass | 410.06738 |
| Heavy Atoms | 23 |
| Complexity | 428.0 |
Chemical Identifiers
| CAS Number | 35871-54-6 |
|---|---|
| SMILES | C(CCNCCCSS(=O)(=O)O)CCNCCCSS(=O)(=O)O |
| InChIKey | IJUPJUUIVPWCDW-UHFFFAOYSA-N |
Product Overview
N,N'-Pentamethylenebis[s-3-aminopropyl thiosulfuric acid] (CAS 35871-54-6), with molecular formula C11H26N2O6S4 and molecular weight 410.07 g/mol. IUPAC: 1,5-bis(3-sulfosulfanylpropylamino)pentane.
Chemical Property Profile of N,N'-Pentamethylenebis[s-3-aminopropyl thiosulfuric acid]
Property Insights of N,N'-Pentamethylenebis[s-3-aminopropyl thiosulfuric acid]
The XLogP value of -4.8 indicates that N,N'-Pentamethylenebis[s-3-aminopropyl thiosulfuric acid] is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 200.0 Ų indicates high polarity, suggesting N,N'-Pentamethylenebis[s-3-aminopropyl thiosulfuric acid] may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, N,N'-Pentamethylenebis[s-3-aminopropyl thiosulfuric acid] has 4 hydrogen bond donor(s) and 10 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 N,N'-Pentamethylenebis[s-3-aminopropyl thiosulfuric acid]?
The CAS number of N,N'-Pentamethylenebis[s-3-aminopropyl thiosulfuric acid] is 35871-54-6.
What is the molecular formula of N,N'-Pentamethylenebis[s-3-aminopropyl thiosulfuric acid]?
The molecular formula of N,N'-Pentamethylenebis[s-3-aminopropyl thiosulfuric acid] is C11H26N2O6S4.
What is the molecular weight of N,N'-Pentamethylenebis[s-3-aminopropyl thiosulfuric acid]?
The molecular weight of N,N'-Pentamethylenebis[s-3-aminopropyl thiosulfuric acid] is 410.07 g/mol.
Where can I buy N,N'-Pentamethylenebis[s-3-aminopropyl thiosulfuric acid]?
You can request a quote for N,N'-Pentamethylenebis[s-3-aminopropyl thiosulfuric acid] directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N,N'-Pentamethylenebis[s-3-aminopropyl thiosulfuric acid]?
Yes, KEHONG BIO provides custom synthesis services for N,N'-Pentamethylenebis[s-3-aminopropyl thiosulfuric acid] and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.