5-(Chloromethyl)-3-(4-(difluoromethoxy)-3-methoxyphenyl)-1,2,4-oxadiazole
TL;DR: 5-(Chloromethyl)-3-(4-(difluoromethoxy)-3-methoxyphenyl)-1,2,4-oxadiazole (CAS 852399-92-9) is a chemical compound with molecular formula C11H9ClF2N2O3 and molecular weight 290.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(chloromethyl)-3-[4-(difluoromethoxy)-3-methoxyphenyl]-1,2,4-oxadiazole
Also Known As: 5-(chloromethyl)-3-[4-(difluoromethoxy)-3-methoxyphenyl]-1,2,4-oxadiazole, 5-(Chloromethyl)-3-(4-(difluoromethoxy)-3-methoxyphenyl)-1,2,4-oxadiazole, 2-methoxy-N-(thiophen-2-ylmethyl)ethanamine, 1,2,4-Oxadiazole, 5-(chloromethyl)-3-[4-(difluoromethoxy)-3-methoxyphenyl]-, 5-(chloromethyl)-3-[4-(difluoromethoxy)-3-methoxy-phenyl]-1,2,4-oxadiazole
| Molecular Formula | C11H9ClF2N2O3 |
|---|---|
| Molecular Weight | 290.03 g/mol |
| LogP | 3.0854 |
| Topological Polar Surface Area | 57.38 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 290.02698 |
| Heavy Atoms | 19 |
| Complexity | 562.62335 |
Chemical Identifiers
| CAS Number | 852399-92-9 |
|---|---|
| SMILES | COC1=C(C=CC(=C1)C2=NOC(=N2)CCl)OC(F)F |
Product Overview
5-(Chloromethyl)-3-(4-(difluoromethoxy)-3-methoxyphenyl)-1,2,4-oxadiazole (CAS 852399-92-9), with molecular formula C11H9ClF2N2O3 and molecular weight 290.03 g/mol. IUPAC: 5-(chloromethyl)-3-[4-(difluoromethoxy)-3-methoxyphenyl]-1,2,4-oxadiazole.
Chemical Property Profile of 5-(Chloromethyl)-3-(4-(difluoromethoxy)-3-methoxyphenyl)-1,2,4-oxadiazole
Property Insights of 5-(Chloromethyl)-3-(4-(difluoromethoxy)-3-methoxyphenyl)-1,2,4-oxadiazole
The XLogP value of 3.0854 indicates that 5-(Chloromethyl)-3-(4-(difluoromethoxy)-3-methoxyphenyl)-1,2,4-oxadiazole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 57.38 Ų, 5-(Chloromethyl)-3-(4-(difluoromethoxy)-3-methoxyphenyl)-1,2,4-oxadiazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-(Chloromethyl)-3-(4-(difluoromethoxy)-3-methoxyphenyl)-1,2,4-oxadiazole has 0 hydrogen bond donor(s) and 5 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 5-(Chloromethyl)-3-(4-(difluoromethoxy)-3-methoxyphenyl)-1,2,4-oxadiazole?
The CAS number of 5-(Chloromethyl)-3-(4-(difluoromethoxy)-3-methoxyphenyl)-1,2,4-oxadiazole is 852399-92-9.
What is the molecular formula of 5-(Chloromethyl)-3-(4-(difluoromethoxy)-3-methoxyphenyl)-1,2,4-oxadiazole?
The molecular formula of 5-(Chloromethyl)-3-(4-(difluoromethoxy)-3-methoxyphenyl)-1,2,4-oxadiazole is C11H9ClF2N2O3.
What is the molecular weight of 5-(Chloromethyl)-3-(4-(difluoromethoxy)-3-methoxyphenyl)-1,2,4-oxadiazole?
The molecular weight of 5-(Chloromethyl)-3-(4-(difluoromethoxy)-3-methoxyphenyl)-1,2,4-oxadiazole is 290.03 g/mol.
Where can I buy 5-(Chloromethyl)-3-(4-(difluoromethoxy)-3-methoxyphenyl)-1,2,4-oxadiazole?
You can request a quote for 5-(Chloromethyl)-3-(4-(difluoromethoxy)-3-methoxyphenyl)-1,2,4-oxadiazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-(Chloromethyl)-3-(4-(difluoromethoxy)-3-methoxyphenyl)-1,2,4-oxadiazole?
Yes, KEHONG BIO provides custom synthesis services for 5-(Chloromethyl)-3-(4-(difluoromethoxy)-3-methoxyphenyl)-1,2,4-oxadiazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.