methyl 5-[[butyl(methyl)amino]diazenyl]-1H-pyrazole-4-carboxylate
TL;DR: methyl 5-[[butyl(methyl)amino]diazenyl]-1H-pyrazole-4-carboxylate (CAS 34039-62-8) is a chemical compound with molecular formula C10H17N5O2 and molecular weight 239.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 5-[[butyl(methyl)amino]diazenyl]-1H-pyrazole-4-carboxylate
Also Known As: 4-methoxy-1-butylamine, methyl 3-[[butyl(methyl)amino]hydrazinylidene]pyrazole-4-car, METHYL (3Z)-3-[(BUTYL-METHYL-AMINO)HYDRAZINYLIDENE]PYRAZOLE-4-CARBOXYLATE, methyl 3-[[butyl(methyl)amino]hydrazinylidene]pyrazole-4-carboxylate
| Molecular Formula | C10H17N5O2 |
|---|---|
| Molecular Weight | 239.14 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 82.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 239.13823 |
| Heavy Atoms | 17 |
| Complexity | 271.0 |
Chemical Identifiers
| CAS Number | 34039-62-8 |
|---|---|
| SMILES | CCCCN(C)N=NC1=C(C=NN1)C(=O)OC |
| InChIKey | LNTUQGRLBQKYTA-UHFFFAOYSA-N |
Product Overview
methyl 5-[[butyl(methyl)amino]diazenyl]-1H-pyrazole-4-carboxylate (CAS 34039-62-8), with molecular formula C10H17N5O2 and molecular weight 239.14 g/mol. IUPAC: methyl 5-[[butyl(methyl)amino]diazenyl]-1H-pyrazole-4-carboxylate.
Chemical Property Profile of methyl 5-[[butyl(methyl)amino]diazenyl]-1H-pyrazole-4-carboxylate
Property Insights of methyl 5-[[butyl(methyl)amino]diazenyl]-1H-pyrazole-4-carboxylate
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for methyl 5-[[butyl(methyl)amino]diazenyl]-1H-pyrazole-4-carboxylate. The TPSA of 82.9 Ų falls within the moderate polarity range, balancing permeability and solubility for methyl 5-[[butyl(methyl)amino]diazenyl]-1H-pyrazole-4-carboxylate. Following Lipinski's Rule of Five, methyl 5-[[butyl(methyl)amino]diazenyl]-1H-pyrazole-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 5-[[butyl(methyl)amino]diazenyl]-1H-pyrazole-4-carboxylate?
The CAS number of methyl 5-[[butyl(methyl)amino]diazenyl]-1H-pyrazole-4-carboxylate is 34039-62-8.
What is the molecular formula of methyl 5-[[butyl(methyl)amino]diazenyl]-1H-pyrazole-4-carboxylate?
The molecular formula of methyl 5-[[butyl(methyl)amino]diazenyl]-1H-pyrazole-4-carboxylate is C10H17N5O2.
What is the molecular weight of methyl 5-[[butyl(methyl)amino]diazenyl]-1H-pyrazole-4-carboxylate?
The molecular weight of methyl 5-[[butyl(methyl)amino]diazenyl]-1H-pyrazole-4-carboxylate is 239.14 g/mol.
Where can I buy methyl 5-[[butyl(methyl)amino]diazenyl]-1H-pyrazole-4-carboxylate?
You can request a quote for methyl 5-[[butyl(methyl)amino]diazenyl]-1H-pyrazole-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 5-[[butyl(methyl)amino]diazenyl]-1H-pyrazole-4-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for methyl 5-[[butyl(methyl)amino]diazenyl]-1H-pyrazole-4-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.