O-benzyl S-(5-(2,4-dichlorophenyl)-1,3,4-oxadiazol-2-yl) carbonothioate
TL;DR: O-benzyl S-(5-(2,4-dichlorophenyl)-1,3,4-oxadiazol-2-yl) carbonothioate (CAS 336181-22-7) is a chemical compound with molecular formula C16H10Cl2N2O3S and molecular weight 379.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
benzyl [5-(2,4-dichlorophenyl)-1,3,4-oxadiazol-2-yl]sulfanylformate
Also Known As: BAS 01108581, O-benzyl S-(5-(2,4-dichlorophenyl)-1,3,4-oxadiazol-2-yl) carbonothioate, benzyl [5-(2,4-dichlorophenyl)-1,3,4-oxadiazol-2-yl]sulfanylformate, O-benzyl S-[5-(2,4-dichlorophenyl)-1,3,4-oxadiazol-2-yl] carbonothioate
| Molecular Formula | C16H10Cl2N2O3S |
|---|---|
| Molecular Weight | 379.98 g/mol |
| LogP | 5.4723 |
| Topological Polar Surface Area | 65.22 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 379.9789 |
| Heavy Atoms | 24 |
| Complexity | 855.5387 |
Chemical Identifiers
| CAS Number | 336181-22-7 |
|---|---|
| SMILES | C1=CC=C(C=C1)COC(=O)SC2=NN=C(O2)C3=C(C=C(C=C3)Cl)Cl |
Product Overview
O-benzyl S-(5-(2,4-dichlorophenyl)-1,3,4-oxadiazol-2-yl) carbonothioate (CAS 336181-22-7), with molecular formula C16H10Cl2N2O3S and molecular weight 379.98 g/mol. IUPAC: benzyl [5-(2,4-dichlorophenyl)-1,3,4-oxadiazol-2-yl]sulfanylformate.
Chemical Property Profile of O-benzyl S-(5-(2,4-dichlorophenyl)-1,3,4-oxadiazol-2-yl) carbonothioate
Property Insights of O-benzyl S-(5-(2,4-dichlorophenyl)-1,3,4-oxadiazol-2-yl) carbonothioate
The XLogP value of 5.4723 indicates that O-benzyl S-(5-(2,4-dichlorophenyl)-1,3,4-oxadiazol-2-yl) carbonothioate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 65.22 Ų falls within the moderate polarity range, balancing permeability and solubility for O-benzyl S-(5-(2,4-dichlorophenyl)-1,3,4-oxadiazol-2-yl) carbonothioate. Following Lipinski's Rule of Five, O-benzyl S-(5-(2,4-dichlorophenyl)-1,3,4-oxadiazol-2-yl) carbonothioate has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of O-benzyl S-(5-(2,4-dichlorophenyl)-1,3,4-oxadiazol-2-yl) carbonothioate?
The CAS number of O-benzyl S-(5-(2,4-dichlorophenyl)-1,3,4-oxadiazol-2-yl) carbonothioate is 336181-22-7.
What is the molecular formula of O-benzyl S-(5-(2,4-dichlorophenyl)-1,3,4-oxadiazol-2-yl) carbonothioate?
The molecular formula of O-benzyl S-(5-(2,4-dichlorophenyl)-1,3,4-oxadiazol-2-yl) carbonothioate is C16H10Cl2N2O3S.
What is the molecular weight of O-benzyl S-(5-(2,4-dichlorophenyl)-1,3,4-oxadiazol-2-yl) carbonothioate?
The molecular weight of O-benzyl S-(5-(2,4-dichlorophenyl)-1,3,4-oxadiazol-2-yl) carbonothioate is 379.98 g/mol.
Where can I buy O-benzyl S-(5-(2,4-dichlorophenyl)-1,3,4-oxadiazol-2-yl) carbonothioate?
You can request a quote for O-benzyl S-(5-(2,4-dichlorophenyl)-1,3,4-oxadiazol-2-yl) carbonothioate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for O-benzyl S-(5-(2,4-dichlorophenyl)-1,3,4-oxadiazol-2-yl) carbonothioate?
Yes, KEHONG BIO provides custom synthesis services for O-benzyl S-(5-(2,4-dichlorophenyl)-1,3,4-oxadiazol-2-yl) carbonothioate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.