Thiodicarb
TL;DR: Thiodicarb (CAS 59669-26-0) is a chemical compound with molecular formula C10H18N4O4S3 and molecular weight 354.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl N-[methyl-[methyl-(1-methylsulfanylethylideneamino)oxycarbonylamino]sulfanylcarbamoyl]oxyethanimidothioate
Also Known As: Larvin, Dicarbasulf, Dicarbosulf, Liushuanwei, Lepicron
| Molecular Formula | C10H18N4O4S3 |
|---|---|
| Molecular Weight | 354.05 g/mol |
| LogP | 1.7 |
| Topological Polar Surface Area | 160.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 8 |
| Exact Mass | 354.049 |
| Heavy Atoms | 21 |
| Complexity | 393.0 |
| Melting Point | 172.6 °C |
| Density | 1.44 g/cu cm at 20 °C |
| Solubility | In water, 19.1 mg/L at 25 °C |
| Vapor Pressure | 0.00007 [mmHg] |
Chemical Identifiers
| CAS Number | 59669-26-0 |
|---|---|
| SMILES | CC(=NOC(=O)N(C)SN(C)C(=O)ON=C(C)SC)SC |
| InChIKey | XDOTVMNBCQVZKG-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Thiodicarb (CAS 59669-26-0), with molecular formula C10H18N4O4S3 and molecular weight 354.05 g/mol. IUPAC: methyl N-[methyl-[methyl-(1-methylsulfanylethylideneamino)oxycarbonylamino]sulfanylcarbamoyl]oxyethanimidothioate.
Chemical Property Profile of Thiodicarb
Property Insights of Thiodicarb
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Thiodicarb. The TPSA of 160.0 Ų indicates high polarity, suggesting Thiodicarb may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Thiodicarb has 0 hydrogen bond donor(s) and 9 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 Thiodicarb?
The CAS number of Thiodicarb is 59669-26-0.
What is the molecular formula of Thiodicarb?
The molecular formula of Thiodicarb is C10H18N4O4S3.
What is the molecular weight of Thiodicarb?
The molecular weight of Thiodicarb is 354.05 g/mol.
Where can I buy Thiodicarb?
You can request a quote for Thiodicarb directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Thiodicarb?
Yes, KEHONG BIO provides custom synthesis services for Thiodicarb and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.