methyl (5E)-5-[(dibutylamino)hydrazinylidene]imidazole-4-carboxylate
TL;DR: methyl (5E)-5-[(dibutylamino)hydrazinylidene]imidazole-4-carboxylate (CAS 36295-91-7) is a chemical compound with molecular formula C13H23N5O2 and molecular weight 281.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 4-[(dibutylamino)diazenyl]-1H-imidazole-5-carboxylate
Also Known As: methyl (5Z)-5-[(dibutylamino)hydrazinylidene]imidazole-4-car, methyl (5E)-5-[(dibutylamino)hydrazinylidene]imidazole-4-carboxylate
| Molecular Formula | C13H23N5O2 |
|---|---|
| Molecular Weight | 281.19 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 82.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 10 |
| Exact Mass | 281.18518 |
| Heavy Atoms | 20 |
| Complexity | 303.0 |
Chemical Identifiers
| CAS Number | 36295-91-7 |
|---|---|
| SMILES | CCCCN(CCCC)N=NC1=C(NC=N1)C(=O)OC |
| InChIKey | NJSKALMPRJQVKZ-UHFFFAOYSA-N |
Product Overview
methyl (5E)-5-[(dibutylamino)hydrazinylidene]imidazole-4-carboxylate (CAS 36295-91-7), with molecular formula C13H23N5O2 and molecular weight 281.19 g/mol. IUPAC: methyl 4-[(dibutylamino)diazenyl]-1H-imidazole-5-carboxylate.
Chemical Property Profile of methyl (5E)-5-[(dibutylamino)hydrazinylidene]imidazole-4-carboxylate
Property Insights of methyl (5E)-5-[(dibutylamino)hydrazinylidene]imidazole-4-carboxylate
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for methyl (5E)-5-[(dibutylamino)hydrazinylidene]imidazole-4-carboxylate. The TPSA of 82.9 Ų falls within the moderate polarity range, balancing permeability and solubility for methyl (5E)-5-[(dibutylamino)hydrazinylidene]imidazole-4-carboxylate. Following Lipinski's Rule of Five, methyl (5E)-5-[(dibutylamino)hydrazinylidene]imidazole-4-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 (5E)-5-[(dibutylamino)hydrazinylidene]imidazole-4-carboxylate?
The CAS number of methyl (5E)-5-[(dibutylamino)hydrazinylidene]imidazole-4-carboxylate is 36295-91-7.
What is the molecular formula of methyl (5E)-5-[(dibutylamino)hydrazinylidene]imidazole-4-carboxylate?
The molecular formula of methyl (5E)-5-[(dibutylamino)hydrazinylidene]imidazole-4-carboxylate is C13H23N5O2.
What is the molecular weight of methyl (5E)-5-[(dibutylamino)hydrazinylidene]imidazole-4-carboxylate?
The molecular weight of methyl (5E)-5-[(dibutylamino)hydrazinylidene]imidazole-4-carboxylate is 281.19 g/mol.
Where can I buy methyl (5E)-5-[(dibutylamino)hydrazinylidene]imidazole-4-carboxylate?
You can request a quote for methyl (5E)-5-[(dibutylamino)hydrazinylidene]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 (5E)-5-[(dibutylamino)hydrazinylidene]imidazole-4-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for methyl (5E)-5-[(dibutylamino)hydrazinylidene]imidazole-4-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.