Oxadiazon acid
TL;DR: Oxadiazon acid (CAS 57198-84-2) is a chemical compound with molecular formula C15H16Cl2N2O5 and molecular weight 374.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[4-(2,4-dichloro-5-propan-2-yloxyphenyl)-5-oxo-1,3,4-oxadiazol-2-yl]-2-methylpropanoic acid
Also Known As: Oxadiazon acid, 2-Phenylthio-1,3-benzodithiol, 2-[4-(2,4-dichloro-5-propan-2-yloxyphenyl)-5-oxo-1,3,4-oxadiazol-2-yl]-2-methylpropanoic acid, 1,3,4-Oxadiazole-2-acetic acid, 4-(2,4-dichloro-5-(1-methylethoxy)phenyl)-4,5-dihydro-alpha,alpha-dimethyl-5-oxo-, 1,3,4-Oxadiazole-2-acetic acid, 4-[2,4-dichloro-5-(1-methylethoxy)phenyl]-4,5-dihydro-.alpha.,.alpha.-dimethyl-5-oxo-
| Molecular Formula | C15H16Cl2N2O5 |
|---|---|
| Molecular Weight | 374.04 g/mol |
| LogP | 4.0 |
| Topological Polar Surface Area | 88.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 374.04364 |
| Heavy Atoms | 24 |
| Complexity | 552.0 |
Chemical Identifiers
| CAS Number | 57198-84-2 |
|---|---|
| SMILES | CC(C)OC1=C(C=C(C(=C1)N2C(=O)OC(=N2)C(C)(C)C(=O)O)Cl)Cl |
| InChIKey | RHAWWZKCMRZMEQ-UHFFFAOYSA-N |
Product Overview
Oxadiazon acid (CAS 57198-84-2), with molecular formula C15H16Cl2N2O5 and molecular weight 374.04 g/mol. IUPAC: 2-[4-(2,4-dichloro-5-propan-2-yloxyphenyl)-5-oxo-1,3,4-oxadiazol-2-yl]-2-methylpropanoic acid.
Chemical Property Profile of Oxadiazon acid
Property Insights of Oxadiazon acid
The XLogP value of 4.0 indicates that Oxadiazon acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 88.4 Ų falls within the moderate polarity range, balancing permeability and solubility for Oxadiazon acid. Following Lipinski's Rule of Five, Oxadiazon acid has 1 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 Oxadiazon acid?
The CAS number of Oxadiazon acid is 57198-84-2.
What is the molecular formula of Oxadiazon acid?
The molecular formula of Oxadiazon acid is C15H16Cl2N2O5.
What is the molecular weight of Oxadiazon acid?
The molecular weight of Oxadiazon acid is 374.04 g/mol.
Where can I buy Oxadiazon acid?
You can request a quote for Oxadiazon acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Oxadiazon acid?
Yes, KEHONG BIO provides custom synthesis services for Oxadiazon acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.