Carbamodithioic acid, ((4-methylphenyl)sulfonyl)-
TL;DR: Carbamodithioic acid, ((4-methylphenyl)sulfonyl)- (CAS 5706-65-0) is a chemical compound with molecular formula C8H9NO2S3 and molecular weight 246.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-methylphenyl)sulfonylcarbamodithioic acid
Also Known As: Tosyliminomethanedithiol, Imidocarbonic acid der., p-tolylsulfonylcarbamodithioic acid, Carbamodithioic acid, ((4-methylphenyl)sulfonyl)-, (4-methylphenyl)sulfonylcarbamodithioic acid
| Molecular Formula | C8H9NO2S3 |
|---|---|
| Molecular Weight | 246.98 g/mol |
| LogP | 1.48802 |
| Topological Polar Surface Area | 46.17 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 246.97954 |
| Heavy Atoms | 14 |
| Complexity | 436.15912 |
Chemical Identifiers
| CAS Number | 5706-65-0 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)NC(=S)S |
Product Overview
Carbamodithioic acid, ((4-methylphenyl)sulfonyl)- (CAS 5706-65-0), with molecular formula C8H9NO2S3 and molecular weight 246.98 g/mol. IUPAC: (4-methylphenyl)sulfonylcarbamodithioic acid.
Chemical Property Profile of Carbamodithioic acid, ((4-methylphenyl)sulfonyl)-
Property Insights of Carbamodithioic acid, ((4-methylphenyl)sulfonyl)-
The XLogP value of 1.48802 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Carbamodithioic acid, ((4-methylphenyl)sulfonyl)-. With a topological polar surface area (TPSA) of 46.17 Ų, Carbamodithioic acid, ((4-methylphenyl)sulfonyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Carbamodithioic acid, ((4-methylphenyl)sulfonyl)- has 2 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 Carbamodithioic acid, ((4-methylphenyl)sulfonyl)-?
The CAS number of Carbamodithioic acid, ((4-methylphenyl)sulfonyl)- is 5706-65-0.
What is the molecular formula of Carbamodithioic acid, ((4-methylphenyl)sulfonyl)-?
The molecular formula of Carbamodithioic acid, ((4-methylphenyl)sulfonyl)- is C8H9NO2S3.
What is the molecular weight of Carbamodithioic acid, ((4-methylphenyl)sulfonyl)-?
The molecular weight of Carbamodithioic acid, ((4-methylphenyl)sulfonyl)- is 246.98 g/mol.
Where can I buy Carbamodithioic acid, ((4-methylphenyl)sulfonyl)-?
You can request a quote for Carbamodithioic acid, ((4-methylphenyl)sulfonyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Carbamodithioic acid, ((4-methylphenyl)sulfonyl)-?
Yes, KEHONG BIO provides custom synthesis services for Carbamodithioic acid, ((4-methylphenyl)sulfonyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.