Methyl naphthalene-2-carbodithioate
TL;DR: Methyl naphthalene-2-carbodithioate (CAS 20849-26-7) is a chemical compound with molecular formula C12H10S2 and molecular weight 218.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl naphthalene-2-carbodithioate
Also Known As: methyl naphthalene-2-carbodithioate, methyl 2-naphthalenecarbodithioate, methylthio-2-naphthylmethane-1-thione, AB-131/25126017
| Molecular Formula | C12H10S2 |
|---|---|
| Molecular Weight | 218.02 g/mol |
| LogP | 3.8783 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 218.0224 |
| Heavy Atoms | 14 |
| Complexity | 474.46036 |
Chemical Identifiers
| CAS Number | 20849-26-7 |
|---|---|
| SMILES | CSC(=S)C1=CC2=CC=CC=C2C=C1 |
Product Overview
Methyl naphthalene-2-carbodithioate (CAS 20849-26-7), with molecular formula C12H10S2 and molecular weight 218.02 g/mol. IUPAC: methyl naphthalene-2-carbodithioate.
Chemical Property Profile of Methyl naphthalene-2-carbodithioate
Property Insights of Methyl naphthalene-2-carbodithioate
The XLogP value of 3.8783 indicates that Methyl naphthalene-2-carbodithioate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, Methyl naphthalene-2-carbodithioate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl naphthalene-2-carbodithioate has 0 hydrogen bond donor(s) and 2 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 Methyl naphthalene-2-carbodithioate?
The CAS number of Methyl naphthalene-2-carbodithioate is 20849-26-7.
What is the molecular formula of Methyl naphthalene-2-carbodithioate?
The molecular formula of Methyl naphthalene-2-carbodithioate is C12H10S2.
What is the molecular weight of Methyl naphthalene-2-carbodithioate?
The molecular weight of Methyl naphthalene-2-carbodithioate is 218.02 g/mol.
Where can I buy Methyl naphthalene-2-carbodithioate?
You can request a quote for Methyl naphthalene-2-carbodithioate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl naphthalene-2-carbodithioate?
Yes, KEHONG BIO provides custom synthesis services for Methyl naphthalene-2-carbodithioate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.