5-(Chloromethyl)-3-(4-methyl-1,2,5-oxadiazol-3-yl)-1,2,4-oxadiazole
TL;DR: 5-(Chloromethyl)-3-(4-methyl-1,2,5-oxadiazol-3-yl)-1,2,4-oxadiazole (CAS 890095-48-4) is a chemical compound with molecular formula C6H5ClN4O2 and molecular weight 200.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[5-(chloromethyl)-1,2,4-oxadiazol-3-yl]-4-methyl-1,2,5-oxadiazole
Also Known As: 5-(chloromethyl)-3-(4-methyl-1,2,5-oxadiazol-3-yl)-1,2,4-oxadiazole, 3-[5-(chloromethyl)-1,2,4-oxadiazol-3-yl]-4-methyl-1,2,5-oxadiazole, 5-(chloromethyl)-3-(4-methyl(1,2,5-oxadiazol-3-yl))-1,2,4-oxadiazole
| Molecular Formula | C6H5ClN4O2 |
|---|---|
| Molecular Weight | 200.01 g/mol |
| LogP | 1.16682 |
| Topological Polar Surface Area | 77.84 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 200.0101 |
| Heavy Atoms | 13 |
| Complexity | 410.1872 |
Chemical Identifiers
| CAS Number | 890095-48-4 |
|---|---|
| SMILES | CC1=NON=C1C2=NOC(=N2)CCl |
Product Overview
5-(Chloromethyl)-3-(4-methyl-1,2,5-oxadiazol-3-yl)-1,2,4-oxadiazole (CAS 890095-48-4), with molecular formula C6H5ClN4O2 and molecular weight 200.01 g/mol. IUPAC: 3-[5-(chloromethyl)-1,2,4-oxadiazol-3-yl]-4-methyl-1,2,5-oxadiazole.
Chemical Property Profile of 5-(Chloromethyl)-3-(4-methyl-1,2,5-oxadiazol-3-yl)-1,2,4-oxadiazole
Property Insights of 5-(Chloromethyl)-3-(4-methyl-1,2,5-oxadiazol-3-yl)-1,2,4-oxadiazole
The XLogP value of 1.16682 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-(Chloromethyl)-3-(4-methyl-1,2,5-oxadiazol-3-yl)-1,2,4-oxadiazole. The TPSA of 77.84 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-(Chloromethyl)-3-(4-methyl-1,2,5-oxadiazol-3-yl)-1,2,4-oxadiazole. Following Lipinski's Rule of Five, 5-(Chloromethyl)-3-(4-methyl-1,2,5-oxadiazol-3-yl)-1,2,4-oxadiazole has 0 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 5-(Chloromethyl)-3-(4-methyl-1,2,5-oxadiazol-3-yl)-1,2,4-oxadiazole?
The CAS number of 5-(Chloromethyl)-3-(4-methyl-1,2,5-oxadiazol-3-yl)-1,2,4-oxadiazole is 890095-48-4.
What is the molecular formula of 5-(Chloromethyl)-3-(4-methyl-1,2,5-oxadiazol-3-yl)-1,2,4-oxadiazole?
The molecular formula of 5-(Chloromethyl)-3-(4-methyl-1,2,5-oxadiazol-3-yl)-1,2,4-oxadiazole is C6H5ClN4O2.
What is the molecular weight of 5-(Chloromethyl)-3-(4-methyl-1,2,5-oxadiazol-3-yl)-1,2,4-oxadiazole?
The molecular weight of 5-(Chloromethyl)-3-(4-methyl-1,2,5-oxadiazol-3-yl)-1,2,4-oxadiazole is 200.01 g/mol.
Where can I buy 5-(Chloromethyl)-3-(4-methyl-1,2,5-oxadiazol-3-yl)-1,2,4-oxadiazole?
You can request a quote for 5-(Chloromethyl)-3-(4-methyl-1,2,5-oxadiazol-3-yl)-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-methyl-1,2,5-oxadiazol-3-yl)-1,2,4-oxadiazole?
Yes, KEHONG BIO provides custom synthesis services for 5-(Chloromethyl)-3-(4-methyl-1,2,5-oxadiazol-3-yl)-1,2,4-oxadiazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.