methyl 2-amino-1H-imidazole-4-carboxylate
TL;DR: methyl 2-amino-1H-imidazole-4-carboxylate (CAS 897920-30-8) is a chemical compound with molecular formula C5H7N3O2 and molecular weight 141.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-amino-1H-imidazole-5-carboxylate
Also Known As: methyl 2-amino-1H-imidazole-5-carboxylate, Methyl 2-amino-1H-imidazole-4-carboxylate, methylaminoimidazolecarboxylate, methyl2-amino-1H-imidazole-5-carboxylate, 2-Aminoimidazole-4-carboxylic acid, methyl ester
| Molecular Formula | C5H7N3O2 |
|---|---|
| Molecular Weight | 141.05 g/mol |
| LogP | -0.1 |
| Topological Polar Surface Area | 81.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 141.05383 |
| Heavy Atoms | 10 |
| Complexity | 139.0 |
Chemical Identifiers
| CAS Number | 897920-30-8 |
|---|---|
| SMILES | COC(=O)C1=CN=C(N1)N |
| InChIKey | NDTWFWAWLBGFQI-UHFFFAOYSA-N |
Product Overview
methyl 2-amino-1H-imidazole-4-carboxylate (CAS 897920-30-8), with molecular formula C5H7N3O2 and molecular weight 141.05 g/mol. IUPAC: methyl 2-amino-1H-imidazole-5-carboxylate.
Chemical Property Profile of methyl 2-amino-1H-imidazole-4-carboxylate
Property Insights of methyl 2-amino-1H-imidazole-4-carboxylate
The XLogP value of -0.1 indicates that methyl 2-amino-1H-imidazole-4-carboxylate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 81.0 Ų falls within the moderate polarity range, balancing permeability and solubility for methyl 2-amino-1H-imidazole-4-carboxylate. Following Lipinski's Rule of Five, methyl 2-amino-1H-imidazole-4-carboxylate has 2 hydrogen bond donor(s) and 4 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 2-amino-1H-imidazole-4-carboxylate?
The CAS number of methyl 2-amino-1H-imidazole-4-carboxylate is 897920-30-8.
What is the molecular formula of methyl 2-amino-1H-imidazole-4-carboxylate?
The molecular formula of methyl 2-amino-1H-imidazole-4-carboxylate is C5H7N3O2.
What is the molecular weight of methyl 2-amino-1H-imidazole-4-carboxylate?
The molecular weight of methyl 2-amino-1H-imidazole-4-carboxylate is 141.05 g/mol.
Where can I buy methyl 2-amino-1H-imidazole-4-carboxylate?
You can request a quote for methyl 2-amino-1H-imidazole-4-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for methyl 2-amino-1H-imidazole-4-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for methyl 2-amino-1H-imidazole-4-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.