Lythidathion
TL;DR: Lythidathion (CAS 2669-32-1) is a chemical compound with molecular formula C7H13N2O4PS3 and molecular weight 315.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(dimethoxyphosphinothioylsulfanylmethyl)-5-ethoxy-1,3,4-thiadiazol-2-one
Also Known As: Lythidathion, Lythidathion [ISO], Caswell No. 427C, Geigy GS-12968, Geigy 12968
| Molecular Formula | C7H13N2O4PS3 |
|---|---|
| Molecular Weight | 315.98 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 143.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 7 |
| Exact Mass | 315.9775 |
| Heavy Atoms | 17 |
| Complexity | 357.0 |
Chemical Identifiers
| CAS Number | 2669-32-1 |
|---|---|
| SMILES | CCOC1=NN(C(=O)S1)CSP(=S)(OC)OC |
| InChIKey | FPMIAGPUNXEUCZ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 7 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Lythidathion (CAS 2669-32-1), with molecular formula C7H13N2O4PS3 and molecular weight 315.98 g/mol. IUPAC: 3-(dimethoxyphosphinothioylsulfanylmethyl)-5-ethoxy-1,3,4-thiadiazol-2-one.
Chemical Property Profile of Lythidathion
Property Insights of Lythidathion
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Lythidathion. The TPSA of 143.0 Ų indicates high polarity, suggesting Lythidathion may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Lythidathion has 0 hydrogen bond donor(s) and 8 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 Lythidathion?
The CAS number of Lythidathion is 2669-32-1.
What is the molecular formula of Lythidathion?
The molecular formula of Lythidathion is C7H13N2O4PS3.
What is the molecular weight of Lythidathion?
The molecular weight of Lythidathion is 315.98 g/mol.
Where can I buy Lythidathion?
You can request a quote for Lythidathion directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Lythidathion?
Yes, KEHONG BIO provides custom synthesis services for Lythidathion and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.