1-((Anilinocarbothioyl)dithio)-4-methylbenzene
TL;DR: 1-((Anilinocarbothioyl)dithio)-4-methylbenzene (CAS 38509-81-8) is a chemical compound with molecular formula C14H13NS3 and molecular weight 291.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-methylphenyl)sulfanyl N-phenylcarbamodithioate
Also Known As: 1-((Anilinocarbothioyl)dithio)-4-methylbenzene, p-tolylsulfanyl N-phenylcarbamodithioate, (4-methylphenyl)sulfanyl N-phenylcarbamodithioate, 1-Methyl-4-[(phenylcarbamothioyl)disulfanyl]benzene, CARBAMO(DITHIOPEROXO)THIOIC ACID, PHENYL-, 4-METHYLPHENYL ESTER
| Molecular Formula | C14H13NS3 |
|---|---|
| Molecular Weight | 291.02 g/mol |
| LogP | 5.13232 |
| Topological Polar Surface Area | 12.03 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 291.02103 |
| Heavy Atoms | 18 |
| Complexity | 508.32214 |
Chemical Identifiers
| CAS Number | 38509-81-8 |
|---|---|
| SMILES | CC1=CC=C(C=C1)SSC(=S)NC2=CC=CC=C2 |
Product Overview
1-((Anilinocarbothioyl)dithio)-4-methylbenzene (CAS 38509-81-8), with molecular formula C14H13NS3 and molecular weight 291.02 g/mol. IUPAC: (4-methylphenyl)sulfanyl N-phenylcarbamodithioate.
Chemical Property Profile of 1-((Anilinocarbothioyl)dithio)-4-methylbenzene
Property Insights of 1-((Anilinocarbothioyl)dithio)-4-methylbenzene
The XLogP value of 5.13232 indicates that 1-((Anilinocarbothioyl)dithio)-4-methylbenzene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 12.03 Ų, 1-((Anilinocarbothioyl)dithio)-4-methylbenzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-((Anilinocarbothioyl)dithio)-4-methylbenzene has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1-((Anilinocarbothioyl)dithio)-4-methylbenzene?
The CAS number of 1-((Anilinocarbothioyl)dithio)-4-methylbenzene is 38509-81-8.
What is the molecular formula of 1-((Anilinocarbothioyl)dithio)-4-methylbenzene?
The molecular formula of 1-((Anilinocarbothioyl)dithio)-4-methylbenzene is C14H13NS3.
What is the molecular weight of 1-((Anilinocarbothioyl)dithio)-4-methylbenzene?
The molecular weight of 1-((Anilinocarbothioyl)dithio)-4-methylbenzene is 291.02 g/mol.
Where can I buy 1-((Anilinocarbothioyl)dithio)-4-methylbenzene?
You can request a quote for 1-((Anilinocarbothioyl)dithio)-4-methylbenzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-((Anilinocarbothioyl)dithio)-4-methylbenzene?
Yes, KEHONG BIO provides custom synthesis services for 1-((Anilinocarbothioyl)dithio)-4-methylbenzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.