3-Imino-3H-1,2-dithiol-5-amine--hydrogen chloride (1/1)
TL;DR: 3-Imino-3H-1,2-dithiol-5-amine--hydrogen chloride (1/1) (CAS 36708-18-6) is a chemical compound with molecular formula C3H5ClN2S2 and molecular weight 167.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5-aminodithiol-3-ylidene)azanium chloride
Also Known As: 3,5-Diamino-1,2-dithiolium chloride, 3,5-Diamino-1,2-dithiol-1-ium chloride, 3,5-diamino-[1,2]dithiolylium chloride, 3,5-diamino-[1,2]dithiolylium; chloride, (5-aminodithiol-3-ylidene)azanium chloride
| Molecular Formula | C3H5ClN2S2 |
|---|---|
| Molecular Weight | 167.96 g/mol |
| LogP | -3.94 |
| Topological Polar Surface Area | 102.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 167.95827 |
| Heavy Atoms | 8 |
| Complexity | 115.0 |
Chemical Identifiers
| CAS Number | 36708-18-6 |
|---|---|
| SMILES | C1=C(SSC1=[NH2+])N.[Cl-] |
| InChIKey | LFOOGZYQOYIBME-UHFFFAOYSA-N |
Product Overview
3-Imino-3H-1,2-dithiol-5-amine--hydrogen chloride (1/1) (CAS 36708-18-6), with molecular formula C3H5ClN2S2 and molecular weight 167.96 g/mol. IUPAC: (5-aminodithiol-3-ylidene)azanium chloride.
Chemical Property Profile of 3-Imino-3H-1,2-dithiol-5-amine--hydrogen chloride (1/1)
Property Insights of 3-Imino-3H-1,2-dithiol-5-amine--hydrogen chloride (1/1)
The XLogP value of -3.94 indicates that 3-Imino-3H-1,2-dithiol-5-amine--hydrogen chloride (1/1) is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 102.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Imino-3H-1,2-dithiol-5-amine--hydrogen chloride (1/1). Following Lipinski's Rule of Five, 3-Imino-3H-1,2-dithiol-5-amine--hydrogen chloride (1/1) 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-Imino-3H-1,2-dithiol-5-amine--hydrogen chloride (1/1)?
The CAS number of 3-Imino-3H-1,2-dithiol-5-amine--hydrogen chloride (1/1) is 36708-18-6.
What is the molecular formula of 3-Imino-3H-1,2-dithiol-5-amine--hydrogen chloride (1/1)?
The molecular formula of 3-Imino-3H-1,2-dithiol-5-amine--hydrogen chloride (1/1) is C3H5ClN2S2.
What is the molecular weight of 3-Imino-3H-1,2-dithiol-5-amine--hydrogen chloride (1/1)?
The molecular weight of 3-Imino-3H-1,2-dithiol-5-amine--hydrogen chloride (1/1) is 167.96 g/mol.
Where can I buy 3-Imino-3H-1,2-dithiol-5-amine--hydrogen chloride (1/1)?
You can request a quote for 3-Imino-3H-1,2-dithiol-5-amine--hydrogen chloride (1/1) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Imino-3H-1,2-dithiol-5-amine--hydrogen chloride (1/1)?
Yes, KEHONG BIO provides custom synthesis services for 3-Imino-3H-1,2-dithiol-5-amine--hydrogen chloride (1/1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.