1,3-Dithiolan-2-imine, hydrochloride
TL;DR: 1,3-Dithiolan-2-imine, hydrochloride (CAS 1072-49-7) is a chemical compound with molecular formula C3H5ClNS2- and molecular weight 153.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,3-dithiolan-2-imine chloride
Also Known As: 1,3-dithiolan-2-imine, hydrochloride, 1,3-dithiolan-2-imine chloride
| Molecular Formula | C3H5ClNS2- |
|---|---|
| Molecular Weight | 153.96 g/mol |
| LogP | -1.59483 |
| Topological Polar Surface Area | 23.85 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 153.9552 |
| Heavy Atoms | 7 |
| Complexity | 67.33516 |
Chemical Identifiers
| CAS Number | 1072-49-7 |
|---|---|
| SMILES | C1CSC(=N)S1.[Cl-] |
Product Overview
1,3-Dithiolan-2-imine, hydrochloride (CAS 1072-49-7), with molecular formula C3H5ClNS2- and molecular weight 153.96 g/mol. IUPAC: 1,3-dithiolan-2-imine chloride.
Chemical Property Profile of 1,3-Dithiolan-2-imine, hydrochloride
Property Insights of 1,3-Dithiolan-2-imine, hydrochloride
The XLogP value of -1.59483 indicates that 1,3-Dithiolan-2-imine, hydrochloride is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 23.85 Ų, 1,3-Dithiolan-2-imine, hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,3-Dithiolan-2-imine, hydrochloride has 1 hydrogen bond donor(s) and 3 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 1,3-Dithiolan-2-imine, hydrochloride?
The CAS number of 1,3-Dithiolan-2-imine, hydrochloride is 1072-49-7.
What is the molecular formula of 1,3-Dithiolan-2-imine, hydrochloride?
The molecular formula of 1,3-Dithiolan-2-imine, hydrochloride is C3H5ClNS2-.
What is the molecular weight of 1,3-Dithiolan-2-imine, hydrochloride?
The molecular weight of 1,3-Dithiolan-2-imine, hydrochloride is 153.96 g/mol.
Where can I buy 1,3-Dithiolan-2-imine, hydrochloride?
You can request a quote for 1,3-Dithiolan-2-imine, hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3-Dithiolan-2-imine, hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for 1,3-Dithiolan-2-imine, hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.