S,S'-Ethylene bis(N-(2-methoxy-5-methylphenyl)thiocarbamate)
TL;DR: S,S'-Ethylene bis(N-(2-methoxy-5-methylphenyl)thiocarbamate) (CAS 199190-04-0) is a chemical compound with molecular formula C20H24N2O4S2 and molecular weight 420.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
S-[2-[(2-methoxy-5-methylphenyl)carbamoylsulfanyl]ethyl] N-(2-methoxy-5-methylphenyl)carbamothioate
Also Known As: S,S'-ETHYLENE BIS(N-(2-METHOXY-5-METHYLPHENYL)THIOCARBAMATE), N-(2-methoxy-5-methylphenyl)[(2-{[(2-methoxy-5-methylphenyl)carbamoyl]sulfanyl}ethyl)sulfanyl]formamide, S-[2-[(2-methoxy-5-methylphenyl)carbamoylsulfanyl]ethyl] N-(2-methoxy-5-methylphenyl)carbamothioate
| Molecular Formula | C20H24N2O4S2 |
|---|---|
| Molecular Weight | 420.12 g/mol |
| LogP | 4.5 |
| Topological Polar Surface Area | 127.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 9 |
| Exact Mass | 420.11774 |
| Heavy Atoms | 28 |
| Complexity | 465.0 |
Chemical Identifiers
| CAS Number | 199190-04-0 |
|---|---|
| SMILES | CC1=CC(=C(C=C1)OC)NC(=O)SCCSC(=O)NC2=C(C=CC(=C2)C)OC |
| InChIKey | YRVGXYUCMVIKAJ-UHFFFAOYSA-N |
Product Overview
S,S'-Ethylene bis(N-(2-methoxy-5-methylphenyl)thiocarbamate) (CAS 199190-04-0), with molecular formula C20H24N2O4S2 and molecular weight 420.12 g/mol. IUPAC: S-[2-[(2-methoxy-5-methylphenyl)carbamoylsulfanyl]ethyl] N-(2-methoxy-5-methylphenyl)carbamothioate.
Chemical Property Profile of S,S'-Ethylene bis(N-(2-methoxy-5-methylphenyl)thiocarbamate)
Property Insights of S,S'-Ethylene bis(N-(2-methoxy-5-methylphenyl)thiocarbamate)
The XLogP value of 4.5 indicates that S,S'-Ethylene bis(N-(2-methoxy-5-methylphenyl)thiocarbamate) is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 127.0 Ų falls within the moderate polarity range, balancing permeability and solubility for S,S'-Ethylene bis(N-(2-methoxy-5-methylphenyl)thiocarbamate). Following Lipinski's Rule of Five, S,S'-Ethylene bis(N-(2-methoxy-5-methylphenyl)thiocarbamate) has 2 hydrogen bond donor(s) and 6 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 S,S'-Ethylene bis(N-(2-methoxy-5-methylphenyl)thiocarbamate)?
The CAS number of S,S'-Ethylene bis(N-(2-methoxy-5-methylphenyl)thiocarbamate) is 199190-04-0.
What is the molecular formula of S,S'-Ethylene bis(N-(2-methoxy-5-methylphenyl)thiocarbamate)?
The molecular formula of S,S'-Ethylene bis(N-(2-methoxy-5-methylphenyl)thiocarbamate) is C20H24N2O4S2.
What is the molecular weight of S,S'-Ethylene bis(N-(2-methoxy-5-methylphenyl)thiocarbamate)?
The molecular weight of S,S'-Ethylene bis(N-(2-methoxy-5-methylphenyl)thiocarbamate) is 420.12 g/mol.
Where can I buy S,S'-Ethylene bis(N-(2-methoxy-5-methylphenyl)thiocarbamate)?
You can request a quote for S,S'-Ethylene bis(N-(2-methoxy-5-methylphenyl)thiocarbamate) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for S,S'-Ethylene bis(N-(2-methoxy-5-methylphenyl)thiocarbamate)?
Yes, KEHONG BIO provides custom synthesis services for S,S'-Ethylene bis(N-(2-methoxy-5-methylphenyl)thiocarbamate) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.