Pyributicarb
TL;DR: Pyributicarb (CAS 88678-67-5) is a chemical compound with molecular formula C18H22N2O2S and molecular weight 330.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
O-(3-tert-butylphenyl) N-(6-methoxy-2-pyridinyl)-N-methylcarbamothioate
Also Known As: Pyributicarb, pyributicarbe, pyributycarb, Pyributicarb [ISO], henyl)ester
| Molecular Formula | C18H22N2O2S |
|---|---|
| Molecular Weight | 330.14 g/mol |
| LogP | 5.2 |
| Topological Polar Surface Area | 66.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 330.1402 |
| Heavy Atoms | 23 |
| Complexity | 397.0 |
Chemical Identifiers
| CAS Number | 88678-67-5 |
|---|---|
| SMILES | CC(C)(C)C1=CC(=CC=C1)OC(=S)N(C)C2=NC(=CC=C2)OC |
| InChIKey | VTRWMTJQBQJKQH-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 12 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Pyributicarb (CAS 88678-67-5), with molecular formula C18H22N2O2S and molecular weight 330.14 g/mol. IUPAC: O-(3-tert-butylphenyl) N-(6-methoxy-2-pyridinyl)-N-methylcarbamothioate.
Chemical Property Profile of Pyributicarb
Property Insights of Pyributicarb
The XLogP value of 5.2 indicates that Pyributicarb is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.7 Ų falls within the moderate polarity range, balancing permeability and solubility for Pyributicarb. Following Lipinski's Rule of Five, Pyributicarb has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Pyributicarb?
The CAS number of Pyributicarb is 88678-67-5.
What is the molecular formula of Pyributicarb?
The molecular formula of Pyributicarb is C18H22N2O2S.
What is the molecular weight of Pyributicarb?
The molecular weight of Pyributicarb is 330.14 g/mol.
Where can I buy Pyributicarb?
You can request a quote for Pyributicarb directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Pyributicarb?
Yes, KEHONG BIO provides custom synthesis services for Pyributicarb and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.