![4-[4-(Dimethylamino)phenyl]-2,6-diphenylthiopyranium structure](/static/products/1403/14039-00-0.webp)
4-[4-(Dimethylamino)phenyl]-2,6-diphenylthiopyranium
TL;DR: 4-[4-(Dimethylamino)phenyl]-2,6-diphenylthiopyranium (CAS 14039-00-0) is a chemical compound with molecular formula C25H22NS+ and molecular weight 368.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-(2,6-diphenylthiopyran-4-ylidene)cyclohexa-2,5-dien-1-ylidene]-dimethylazanium
Also Known As: 4-[4-(dimethylamino)phenyl]-2,6-diphenylthiopyranium, 2,6-Diphenyl-4-[4-(dimethylamino)phenyl]thiopyrylium, 4-[4-(Dimethylamino)phenyl]-2,6-diphenylthiopyrylium, 4-[4-(dimethylamino)phenyl]-2,6-diphenyl-1lambda4-thiopyran-1-ylium, n-[4-(2,6-diphenyl-4h-thiopyran-4-ylidene)cyclohexa-2,5-dien-1-ylidene]-n-methylmethanaminium
| Molecular Formula | C25H22NS+ |
|---|---|
| Molecular Weight | 368.15 g/mol |
| LogP | 5.2 |
| Topological Polar Surface Area | 28.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 368.1473 |
| Heavy Atoms | 27 |
| Complexity | 689.0 |
Chemical Identifiers
| CAS Number | 14039-00-0 |
|---|---|
| SMILES | C[N+](=C1C=CC(=C2C=C(SC(=C2)C3=CC=CC=C3)C4=CC=CC=C4)C=C1)C |
| InChIKey | IWBBAVPUHLAWGW-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 8 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-[4-(Dimethylamino)phenyl]-2,6-diphenylthiopyranium (CAS 14039-00-0), with molecular formula C25H22NS+ and molecular weight 368.15 g/mol. IUPAC: [4-(2,6-diphenylthiopyran-4-ylidene)cyclohexa-2,5-dien-1-ylidene]-dimethylazanium.
Chemical Property Profile of 4-[4-(Dimethylamino)phenyl]-2,6-diphenylthiopyranium
Property Insights of 4-[4-(Dimethylamino)phenyl]-2,6-diphenylthiopyranium
The XLogP value of 5.2 indicates that 4-[4-(Dimethylamino)phenyl]-2,6-diphenylthiopyranium is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 28.3 Ų, 4-[4-(Dimethylamino)phenyl]-2,6-diphenylthiopyranium exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-[4-(Dimethylamino)phenyl]-2,6-diphenylthiopyranium has 0 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4-[4-(Dimethylamino)phenyl]-2,6-diphenylthiopyranium?
The CAS number of 4-[4-(Dimethylamino)phenyl]-2,6-diphenylthiopyranium is 14039-00-0.
What is the molecular formula of 4-[4-(Dimethylamino)phenyl]-2,6-diphenylthiopyranium?
The molecular formula of 4-[4-(Dimethylamino)phenyl]-2,6-diphenylthiopyranium is C25H22NS+.
What is the molecular weight of 4-[4-(Dimethylamino)phenyl]-2,6-diphenylthiopyranium?
The molecular weight of 4-[4-(Dimethylamino)phenyl]-2,6-diphenylthiopyranium is 368.15 g/mol.
Where can I buy 4-[4-(Dimethylamino)phenyl]-2,6-diphenylthiopyranium?
You can request a quote for 4-[4-(Dimethylamino)phenyl]-2,6-diphenylthiopyranium 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]-2,6-diphenylthiopyranium?
Yes, KEHONG BIO provides custom synthesis services for 4-[4-(Dimethylamino)phenyl]-2,6-diphenylthiopyranium and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.