2,5-Diamino-1,4-benzenedithiol
TL;DR: 2,5-Diamino-1,4-benzenedithiol (CAS 75464-52-7) is a chemical compound with molecular formula C6H8N2S2 and molecular weight 172.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,5-diaminobenzene-1,4-dithiol
Also Known As: 2,5-diaminobenzene-1,4-dithiol, 2,5-diamino-1,4-benzenedithiol, starbld0002122, 2,5-Dimercaptobenzene-1,4-diamine, 1,4-Benzenedithiol, 2,5-diamino-
| Molecular Formula | C6H8N2S2 |
|---|---|
| Molecular Weight | 172.01 g/mol |
| LogP | 1.4284 |
| Topological Polar Surface Area | 52.04 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 172.0129 |
| Heavy Atoms | 10 |
| Complexity | 209.91988 |
Chemical Identifiers
| CAS Number | 75464-52-7 |
|---|---|
| SMILES | C1=C(C(=CC(=C1S)N)S)N |
Product Overview
2,5-Diamino-1,4-benzenedithiol (CAS 75464-52-7), with molecular formula C6H8N2S2 and molecular weight 172.01 g/mol. IUPAC: 2,5-diaminobenzene-1,4-dithiol.
Chemical Property Profile of 2,5-Diamino-1,4-benzenedithiol
Property Insights of 2,5-Diamino-1,4-benzenedithiol
The XLogP value of 1.4284 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,5-Diamino-1,4-benzenedithiol. With a topological polar surface area (TPSA) of 52.04 Ų, 2,5-Diamino-1,4-benzenedithiol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,5-Diamino-1,4-benzenedithiol has 4 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 2,5-Diamino-1,4-benzenedithiol?
The CAS number of 2,5-Diamino-1,4-benzenedithiol is 75464-52-7.
What is the molecular formula of 2,5-Diamino-1,4-benzenedithiol?
The molecular formula of 2,5-Diamino-1,4-benzenedithiol is C6H8N2S2.
What is the molecular weight of 2,5-Diamino-1,4-benzenedithiol?
The molecular weight of 2,5-Diamino-1,4-benzenedithiol is 172.01 g/mol.
Where can I buy 2,5-Diamino-1,4-benzenedithiol?
You can request a quote for 2,5-Diamino-1,4-benzenedithiol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,5-Diamino-1,4-benzenedithiol?
Yes, KEHONG BIO provides custom synthesis services for 2,5-Diamino-1,4-benzenedithiol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.