Methyl 4-amino-1,2,5-oxadiazole-3-carboxylate
TL;DR: Methyl 4-amino-1,2,5-oxadiazole-3-carboxylate (CAS 90446-25-6) is a chemical compound with molecular formula C4H5N3O3 and molecular weight 143.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 4-amino-1,2,5-oxadiazole-3-carboxylate
Also Known As: methyl 4-amino-1,2,5-oxadiazole-3-carboxylate, null, 4-Amino-furazan-3-carboxylic acid methyl ester, 4-(difluoromethoxy)benzonitrile, ZERO/003192
| Molecular Formula | C4H5N3O3 |
|---|---|
| Molecular Weight | 143.03 g/mol |
| LogP | -0.5616 |
| Topological Polar Surface Area | 91.24 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 1 |
| Exact Mass | 143.0331 |
| Heavy Atoms | 10 |
| Complexity | 243.65079 |
Chemical Identifiers
| CAS Number | 90446-25-6 |
|---|---|
| SMILES | COC(=O)C1=NON=C1N |
Product Overview
Methyl 4-amino-1,2,5-oxadiazole-3-carboxylate (CAS 90446-25-6), with molecular formula C4H5N3O3 and molecular weight 143.03 g/mol. IUPAC: methyl 4-amino-1,2,5-oxadiazole-3-carboxylate.
Chemical Property Profile of Methyl 4-amino-1,2,5-oxadiazole-3-carboxylate
Property Insights of Methyl 4-amino-1,2,5-oxadiazole-3-carboxylate
The XLogP value of -0.5616 indicates that Methyl 4-amino-1,2,5-oxadiazole-3-carboxylate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 91.24 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 4-amino-1,2,5-oxadiazole-3-carboxylate. Following Lipinski's Rule of Five, Methyl 4-amino-1,2,5-oxadiazole-3-carboxylate 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 Methyl 4-amino-1,2,5-oxadiazole-3-carboxylate?
The CAS number of Methyl 4-amino-1,2,5-oxadiazole-3-carboxylate is 90446-25-6.
What is the molecular formula of Methyl 4-amino-1,2,5-oxadiazole-3-carboxylate?
The molecular formula of Methyl 4-amino-1,2,5-oxadiazole-3-carboxylate is C4H5N3O3.
What is the molecular weight of Methyl 4-amino-1,2,5-oxadiazole-3-carboxylate?
The molecular weight of Methyl 4-amino-1,2,5-oxadiazole-3-carboxylate is 143.03 g/mol.
Where can I buy Methyl 4-amino-1,2,5-oxadiazole-3-carboxylate?
You can request a quote for Methyl 4-amino-1,2,5-oxadiazole-3-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 4-amino-1,2,5-oxadiazole-3-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 4-amino-1,2,5-oxadiazole-3-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.