4-(4-(Dimethylamino)phenyl-1,3-dithiole-2-thione
TL;DR: 4-(4-(Dimethylamino)phenyl-1,3-dithiole-2-thione (CAS 3608-37-5) is a chemical compound with molecular formula C11H11NS3 and molecular weight 253.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[4-(dimethylamino)phenyl]-1,3-dithiole-2-thione
Also Known As: 4-(4-dimethylaminophenyl)-1,3-dithiole-2-thione, 4-(4-(DIMETHYLAMINO)PHENYL-1,3-DITHIOLE-2-THIONE, 4-(4-dimethylamino-phenyl)-[1,3]dithiole-2-thione, 4-(4-(Dimethylamino)phenyl)-1,3-dithiole-2-thione, 636-843-1
| Molecular Formula | C11H11NS3 |
|---|---|
| Molecular Weight | 253.01 g/mol |
| LogP | 4.27209 |
| Topological Polar Surface Area | 3.24 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 253.00536 |
| Heavy Atoms | 15 |
| Complexity | 493.05164 |
Chemical Identifiers
| CAS Number | 3608-37-5 |
|---|---|
| SMILES | CN(C)C1=CC=C(C=C1)C2=CSC(=S)S2 |
Product Overview
4-(4-(Dimethylamino)phenyl-1,3-dithiole-2-thione (CAS 3608-37-5), with molecular formula C11H11NS3 and molecular weight 253.01 g/mol. IUPAC: 4-[4-(dimethylamino)phenyl]-1,3-dithiole-2-thione.
Chemical Property Profile of 4-(4-(Dimethylamino)phenyl-1,3-dithiole-2-thione
Property Insights of 4-(4-(Dimethylamino)phenyl-1,3-dithiole-2-thione
The XLogP value of 4.27209 indicates that 4-(4-(Dimethylamino)phenyl-1,3-dithiole-2-thione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 3.24 Ų, 4-(4-(Dimethylamino)phenyl-1,3-dithiole-2-thione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(4-(Dimethylamino)phenyl-1,3-dithiole-2-thione has 0 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 4-(4-(Dimethylamino)phenyl-1,3-dithiole-2-thione?
The CAS number of 4-(4-(Dimethylamino)phenyl-1,3-dithiole-2-thione is 3608-37-5.
What is the molecular formula of 4-(4-(Dimethylamino)phenyl-1,3-dithiole-2-thione?
The molecular formula of 4-(4-(Dimethylamino)phenyl-1,3-dithiole-2-thione is C11H11NS3.
What is the molecular weight of 4-(4-(Dimethylamino)phenyl-1,3-dithiole-2-thione?
The molecular weight of 4-(4-(Dimethylamino)phenyl-1,3-dithiole-2-thione is 253.01 g/mol.
Where can I buy 4-(4-(Dimethylamino)phenyl-1,3-dithiole-2-thione?
You can request a quote for 4-(4-(Dimethylamino)phenyl-1,3-dithiole-2-thione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(4-(Dimethylamino)phenyl-1,3-dithiole-2-thione?
Yes, KEHONG BIO provides custom synthesis services for 4-(4-(Dimethylamino)phenyl-1,3-dithiole-2-thione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.