Pyrazole-4-carboxylic acid, 5-(N,N,1-trimethylformimidoyl)-, ethyl ester
TL;DR: Pyrazole-4-carboxylic acid, 5-(N,N,1-trimethylformimidoyl)-, ethyl ester (CAS 66751-70-0) is a chemical compound with molecular formula C10H16N4O2 and molecular weight 224.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 5-[(Z)-1-(dimethylamino)ethylideneamino]-1H-pyrazole-4-carboxylate
Also Known As: 5-((1-(Dimethylamino)vinyl)amino)pyrazole-4-carboxylic acid ethyl ester, Pyrazole-4-carboxylic acid, 5-(N,N,1-trimethylformimidoyl)-, ethyl ester, 5-(N,N,1-Trimethylformimidoyl)pyrazole-4-carboxylic acid ethyl ester, RefChem:1097240, BRN 5025707
| Molecular Formula | C10H16N4O2 |
|---|---|
| Molecular Weight | 224.13 g/mol |
| LogP | 1.1979 |
| Topological Polar Surface Area | 70.58 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 224.12732 |
| Heavy Atoms | 16 |
| Complexity | 395.27823 |
Chemical Identifiers
| CAS Number | 66751-70-0 |
|---|---|
| SMILES | CCOC(=O)C1=C(NN=C1)/N=C(/C)\N(C)C |
Product Overview
Pyrazole-4-carboxylic acid, 5-(N,N,1-trimethylformimidoyl)-, ethyl ester (CAS 66751-70-0), with molecular formula C10H16N4O2 and molecular weight 224.13 g/mol. IUPAC: ethyl 5-[(Z)-1-(dimethylamino)ethylideneamino]-1H-pyrazole-4-carboxylate.
Chemical Property Profile of Pyrazole-4-carboxylic acid, 5-(N,N,1-trimethylformimidoyl)-, ethyl ester
Property Insights of Pyrazole-4-carboxylic acid, 5-(N,N,1-trimethylformimidoyl)-, ethyl ester
The XLogP value of 1.1979 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Pyrazole-4-carboxylic acid, 5-(N,N,1-trimethylformimidoyl)-, ethyl ester. The TPSA of 70.58 Ų falls within the moderate polarity range, balancing permeability and solubility for Pyrazole-4-carboxylic acid, 5-(N,N,1-trimethylformimidoyl)-, ethyl ester. Following Lipinski's Rule of Five, Pyrazole-4-carboxylic acid, 5-(N,N,1-trimethylformimidoyl)-, ethyl ester has 1 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 Pyrazole-4-carboxylic acid, 5-(N,N,1-trimethylformimidoyl)-, ethyl ester?
The CAS number of Pyrazole-4-carboxylic acid, 5-(N,N,1-trimethylformimidoyl)-, ethyl ester is 66751-70-0.
What is the molecular formula of Pyrazole-4-carboxylic acid, 5-(N,N,1-trimethylformimidoyl)-, ethyl ester?
The molecular formula of Pyrazole-4-carboxylic acid, 5-(N,N,1-trimethylformimidoyl)-, ethyl ester is C10H16N4O2.
What is the molecular weight of Pyrazole-4-carboxylic acid, 5-(N,N,1-trimethylformimidoyl)-, ethyl ester?
The molecular weight of Pyrazole-4-carboxylic acid, 5-(N,N,1-trimethylformimidoyl)-, ethyl ester is 224.13 g/mol.
Where can I buy Pyrazole-4-carboxylic acid, 5-(N,N,1-trimethylformimidoyl)-, ethyl ester?
You can request a quote for Pyrazole-4-carboxylic acid, 5-(N,N,1-trimethylformimidoyl)-, ethyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Pyrazole-4-carboxylic acid, 5-(N,N,1-trimethylformimidoyl)-, ethyl ester?
Yes, KEHONG BIO provides custom synthesis services for Pyrazole-4-carboxylic acid, 5-(N,N,1-trimethylformimidoyl)-, ethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.