3-(Hexadecylamino)-1-propanesulfonic acid
TL;DR: 3-(Hexadecylamino)-1-propanesulfonic acid (CAS 1120-05-4) is a chemical compound with molecular formula C19H41NO3S and molecular weight 363.28 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(hexadecylamino)propane-1-sulfonic acid
Also Known As: 3-(Hexadecylamino)-1-propanesulfonic acid, 3-(hexadecylamino)propane-1-sulfonic acid, N-hexadecyl-3-aminopropanesulfonic acid, 1-Propanesulfonic acid,3-(hexadecylamino), 1-Propanesulfonic acid,3-(hexadecylamino)-
| Molecular Formula | C19H41NO3S |
|---|---|
| Molecular Weight | 363.28 g/mol |
| LogP | 4.5 |
| Topological Polar Surface Area | 74.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 19 |
| Exact Mass | 363.2807 |
| Heavy Atoms | 24 |
| Complexity | 339.0 |
Chemical Identifiers
| CAS Number | 1120-05-4 |
|---|---|
| SMILES | CCCCCCCCCCCCCCCCNCCCS(=O)(=O)O |
| InChIKey | FBONKMDYOCCKKV-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-(Hexadecylamino)-1-propanesulfonic acid (CAS 1120-05-4), with molecular formula C19H41NO3S and molecular weight 363.28 g/mol. IUPAC: 3-(hexadecylamino)propane-1-sulfonic acid.
Chemical Property Profile of 3-(Hexadecylamino)-1-propanesulfonic acid
Property Insights of 3-(Hexadecylamino)-1-propanesulfonic acid
The XLogP value of 4.5 indicates that 3-(Hexadecylamino)-1-propanesulfonic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 74.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(Hexadecylamino)-1-propanesulfonic acid. Following Lipinski's Rule of Five, 3-(Hexadecylamino)-1-propanesulfonic acid has 2 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 3-(Hexadecylamino)-1-propanesulfonic acid?
The CAS number of 3-(Hexadecylamino)-1-propanesulfonic acid is 1120-05-4.
What is the molecular formula of 3-(Hexadecylamino)-1-propanesulfonic acid?
The molecular formula of 3-(Hexadecylamino)-1-propanesulfonic acid is C19H41NO3S.
What is the molecular weight of 3-(Hexadecylamino)-1-propanesulfonic acid?
The molecular weight of 3-(Hexadecylamino)-1-propanesulfonic acid is 363.28 g/mol.
Where can I buy 3-(Hexadecylamino)-1-propanesulfonic acid?
You can request a quote for 3-(Hexadecylamino)-1-propanesulfonic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(Hexadecylamino)-1-propanesulfonic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-(Hexadecylamino)-1-propanesulfonic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.