Dimethenamid
TL;DR: Dimethenamid (CAS 87674-68-8) is a chemical compound with molecular formula C12H18ClNO2S and molecular weight 275.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-chloro-N-(2,4-dimethylthiophen-3-yl)-N-(1-methoxypropan-2-yl)acetamide
Also Known As: Dimethenamid, frontier, Frontier Herbicide, Dimethenamide, fronier
| Molecular Formula | C12H18ClNO2S |
|---|---|
| Molecular Weight | 275.07 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 57.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 275.07468 |
| Heavy Atoms | 17 |
| Complexity | 265.0 |
| Boiling Point | BP: 127 °C at 26.7 Pa |
| Density | 1.187 at 25 °C |
| Solubility | In water, 1174 mg/L at 25 °C |
| Vapor Pressure | VP: 36.7 mPa at 25 °C |
Chemical Identifiers
| CAS Number | 87674-68-8 |
|---|---|
| SMILES | CC1=CSC(=C1N(C(C)COC)C(=O)CCl)C |
| InChIKey | JLYFCTQDENRSOL-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 12 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Dimethenamid (CAS 87674-68-8), with molecular formula C12H18ClNO2S and molecular weight 275.07 g/mol. IUPAC: 2-chloro-N-(2,4-dimethylthiophen-3-yl)-N-(1-methoxypropan-2-yl)acetamide.
Chemical Property Profile of Dimethenamid
Property Insights of Dimethenamid
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Dimethenamid. With a topological polar surface area (TPSA) of 57.8 Ų, Dimethenamid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Dimethenamid has 0 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 Dimethenamid?
The CAS number of Dimethenamid is 87674-68-8.
What is the molecular formula of Dimethenamid?
The molecular formula of Dimethenamid is C12H18ClNO2S.
What is the molecular weight of Dimethenamid?
The molecular weight of Dimethenamid is 275.07 g/mol.
Where can I buy Dimethenamid?
You can request a quote for Dimethenamid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dimethenamid?
Yes, KEHONG BIO provides custom synthesis services for Dimethenamid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.