methyl 4-(dimethylaminodiazenyl)-5-propan-2-yl-1H-pyrazole-3-carboxylate
TL;DR: methyl 4-(dimethylaminodiazenyl)-5-propan-2-yl-1H-pyrazole-3-carboxylate (CAS 66975-17-5) 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 4-(dimethylaminodiazenyl)-5-propan-2-yl-1H-pyrazole-3-carboxylate
Also Known As: methyl 4-(dimethylaminodiazenyl)-5-propan-2-yl-1H-pyrazole-3-carboxylate, methyl 4-(dimethylaminohydrazinylidene)-5-propan-2-ylpyrazole-3-carboxylate, 1H-Pyrazole-3-carboxylic acid,3-dimethyl-1-triazenyl)-5-(1-methylethyl)-, methyl ester, Methyl (4Z)-4-(3,3-dimethyltriazan-1-ylidene)-5-(propan-2-yl)-4H-pyrazole-3-carboxylate, methyl (4Z)-4-(dimethylaminohydrazinylidene)-5-propan-2-ylpyrazole-3-carboxylate
| Molecular Formula | C10H17N5O2 |
|---|---|
| Molecular Weight | 239.14 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 82.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 239.13823 |
| Heavy Atoms | 17 |
| Complexity | 292.0 |
Chemical Identifiers
| CAS Number | 66975-17-5 |
|---|---|
| SMILES | CC(C)C1=C(C(=NN1)C(=O)OC)N=NN(C)C |
| InChIKey | JRZJIRHQQNYGSS-UHFFFAOYSA-N |
Product Overview
methyl 4-(dimethylaminodiazenyl)-5-propan-2-yl-1H-pyrazole-3-carboxylate (CAS 66975-17-5), with molecular formula C10H17N5O2 and molecular weight 239.14 g/mol. IUPAC: methyl 4-(dimethylaminodiazenyl)-5-propan-2-yl-1H-pyrazole-3-carboxylate.
Chemical Property Profile of methyl 4-(dimethylaminodiazenyl)-5-propan-2-yl-1H-pyrazole-3-carboxylate
Property Insights of methyl 4-(dimethylaminodiazenyl)-5-propan-2-yl-1H-pyrazole-3-carboxylate
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for methyl 4-(dimethylaminodiazenyl)-5-propan-2-yl-1H-pyrazole-3-carboxylate. The TPSA of 82.9 Ų falls within the moderate polarity range, balancing permeability and solubility for methyl 4-(dimethylaminodiazenyl)-5-propan-2-yl-1H-pyrazole-3-carboxylate. Following Lipinski's Rule of Five, methyl 4-(dimethylaminodiazenyl)-5-propan-2-yl-1H-pyrazole-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-(dimethylaminodiazenyl)-5-propan-2-yl-1H-pyrazole-3-carboxylate?
The CAS number of methyl 4-(dimethylaminodiazenyl)-5-propan-2-yl-1H-pyrazole-3-carboxylate is 66975-17-5.
What is the molecular formula of methyl 4-(dimethylaminodiazenyl)-5-propan-2-yl-1H-pyrazole-3-carboxylate?
The molecular formula of methyl 4-(dimethylaminodiazenyl)-5-propan-2-yl-1H-pyrazole-3-carboxylate is C10H17N5O2.
What is the molecular weight of methyl 4-(dimethylaminodiazenyl)-5-propan-2-yl-1H-pyrazole-3-carboxylate?
The molecular weight of methyl 4-(dimethylaminodiazenyl)-5-propan-2-yl-1H-pyrazole-3-carboxylate is 239.14 g/mol.
Where can I buy methyl 4-(dimethylaminodiazenyl)-5-propan-2-yl-1H-pyrazole-3-carboxylate?
You can request a quote for methyl 4-(dimethylaminodiazenyl)-5-propan-2-yl-1H-pyrazole-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-(dimethylaminodiazenyl)-5-propan-2-yl-1H-pyrazole-3-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for methyl 4-(dimethylaminodiazenyl)-5-propan-2-yl-1H-pyrazole-3-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.