![(4E)-4-[(Methylsulfanyl)(sulfanyl)methylidene]naphthalen-1(4H)-one structure](/static/products/6208/62082-20-6.webp)
(4E)-4-[(Methylsulfanyl)(sulfanyl)methylidene]naphthalen-1(4H)-one
TL;DR: (4E)-4-[(Methylsulfanyl)(sulfanyl)methylidene]naphthalen-1(4H)-one (CAS 62082-20-6) is a chemical compound with molecular formula C12H10OS2 and molecular weight 234.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 4-hydroxynaphthalene-1-carbodithioate
Also Known As: 4-[methylsulfanyl(sulfanyl)methylidene]naphthalen-1-one, (4E)-4-[(Methylsulfanyl)(sulfanyl)methylidene]naphthalen-1(4H)-one, (4E)-4-[methylsulfanyl(sulfanyl)methylidene]naphthalen-1-one
| Molecular Formula | C12H10OS2 |
|---|---|
| Molecular Weight | 234.02 g/mol |
| LogP | 4.3 |
| Topological Polar Surface Area | 77.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 234.0173 |
| Heavy Atoms | 15 |
| Complexity | 242.0 |
Chemical Identifiers
| CAS Number | 62082-20-6 |
|---|---|
| SMILES | CSC(=S)C1=CC=C(C2=CC=CC=C21)O |
| InChIKey | TZGNQUXJSKFTJU-UHFFFAOYSA-N |
Product Overview
(4E)-4-[(Methylsulfanyl)(sulfanyl)methylidene]naphthalen-1(4H)-one (CAS 62082-20-6), with molecular formula C12H10OS2 and molecular weight 234.02 g/mol. IUPAC: methyl 4-hydroxynaphthalene-1-carbodithioate.
Chemical Property Profile of (4E)-4-[(Methylsulfanyl)(sulfanyl)methylidene]naphthalen-1(4H)-one
Property Insights of (4E)-4-[(Methylsulfanyl)(sulfanyl)methylidene]naphthalen-1(4H)-one
The XLogP value of 4.3 indicates that (4E)-4-[(Methylsulfanyl)(sulfanyl)methylidene]naphthalen-1(4H)-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 77.6 Ų falls within the moderate polarity range, balancing permeability and solubility for (4E)-4-[(Methylsulfanyl)(sulfanyl)methylidene]naphthalen-1(4H)-one. Following Lipinski's Rule of Five, (4E)-4-[(Methylsulfanyl)(sulfanyl)methylidene]naphthalen-1(4H)-one 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 (4E)-4-[(Methylsulfanyl)(sulfanyl)methylidene]naphthalen-1(4H)-one?
The CAS number of (4E)-4-[(Methylsulfanyl)(sulfanyl)methylidene]naphthalen-1(4H)-one is 62082-20-6.
What is the molecular formula of (4E)-4-[(Methylsulfanyl)(sulfanyl)methylidene]naphthalen-1(4H)-one?
The molecular formula of (4E)-4-[(Methylsulfanyl)(sulfanyl)methylidene]naphthalen-1(4H)-one is C12H10OS2.
What is the molecular weight of (4E)-4-[(Methylsulfanyl)(sulfanyl)methylidene]naphthalen-1(4H)-one?
The molecular weight of (4E)-4-[(Methylsulfanyl)(sulfanyl)methylidene]naphthalen-1(4H)-one is 234.02 g/mol.
Where can I buy (4E)-4-[(Methylsulfanyl)(sulfanyl)methylidene]naphthalen-1(4H)-one?
You can request a quote for (4E)-4-[(Methylsulfanyl)(sulfanyl)methylidene]naphthalen-1(4H)-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (4E)-4-[(Methylsulfanyl)(sulfanyl)methylidene]naphthalen-1(4H)-one?
Yes, KEHONG BIO provides custom synthesis services for (4E)-4-[(Methylsulfanyl)(sulfanyl)methylidene]naphthalen-1(4H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.