Carbamodithioic acid, dimethyl-, 2-naphthalenyl ester
TL;DR: Carbamodithioic acid, dimethyl-, 2-naphthalenyl ester (CAS 19405-95-9) is a chemical compound with molecular formula C13H13NS2 and molecular weight 247.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
naphthalen-2-yl N,N-dimethylcarbamodithioate
Also Known As: Naphthalen-2-yl dimethylcarbamodithioate, Carbamodithioic acid, dimethyl-, 2-naphthalenyl ester, naphthalen-2-yl N,N-dimethylcarbamodithioate, RefChem:332849
| Molecular Formula | C13H13NS2 |
|---|---|
| Molecular Weight | 247.05 g/mol |
| LogP | 3.7784 |
| Topological Polar Surface Area | 3.24 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 247.04893 |
| Heavy Atoms | 16 |
| Complexity | 520.0765 |
Chemical Identifiers
| CAS Number | 19405-95-9 |
|---|---|
| SMILES | CN(C)C(=S)SC1=CC2=CC=CC=C2C=C1 |
Product Overview
Carbamodithioic acid, dimethyl-, 2-naphthalenyl ester (CAS 19405-95-9), with molecular formula C13H13NS2 and molecular weight 247.05 g/mol. IUPAC: naphthalen-2-yl N,N-dimethylcarbamodithioate.
Chemical Property Profile of Carbamodithioic acid, dimethyl-, 2-naphthalenyl ester
Property Insights of Carbamodithioic acid, dimethyl-, 2-naphthalenyl ester
The XLogP value of 3.7784 indicates that Carbamodithioic acid, dimethyl-, 2-naphthalenyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 3.24 Ų, Carbamodithioic acid, dimethyl-, 2-naphthalenyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Carbamodithioic acid, dimethyl-, 2-naphthalenyl ester 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 Carbamodithioic acid, dimethyl-, 2-naphthalenyl ester?
The CAS number of Carbamodithioic acid, dimethyl-, 2-naphthalenyl ester is 19405-95-9.
What is the molecular formula of Carbamodithioic acid, dimethyl-, 2-naphthalenyl ester?
The molecular formula of Carbamodithioic acid, dimethyl-, 2-naphthalenyl ester is C13H13NS2.
What is the molecular weight of Carbamodithioic acid, dimethyl-, 2-naphthalenyl ester?
The molecular weight of Carbamodithioic acid, dimethyl-, 2-naphthalenyl ester is 247.05 g/mol.
Where can I buy Carbamodithioic acid, dimethyl-, 2-naphthalenyl ester?
You can request a quote for Carbamodithioic acid, dimethyl-, 2-naphthalenyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Carbamodithioic acid, dimethyl-, 2-naphthalenyl ester?
Yes, KEHONG BIO provides custom synthesis services for Carbamodithioic acid, dimethyl-, 2-naphthalenyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.