![ethyl 5-[(1-methylazepan-2-ylidene)amino]-1H-pyrazole-4-carboxylate structure](/static/products/6675/66751-73-3.webp)
ethyl 5-[(1-methylazepan-2-ylidene)amino]-1H-pyrazole-4-carboxylate
TL;DR: ethyl 5-[(1-methylazepan-2-ylidene)amino]-1H-pyrazole-4-carboxylate (CAS 66751-73-3) is a chemical compound with molecular formula C13H20N4O2 and molecular weight 264.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 5-[(1-methylazepan-2-ylidene)amino]-1H-pyrazole-4-carboxylate
Also Known As: Pyrazole-4-carboxylicacid,5-( -,ethylester
| Molecular Formula | C13H20N4O2 |
|---|---|
| Molecular Weight | 264.16 g/mol |
| LogP | 2.1222 |
| Topological Polar Surface Area | 70.58 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 264.15863 |
| Heavy Atoms | 19 |
| Complexity | 466.9632 |
Chemical Identifiers
| CAS Number | 66751-73-3 |
|---|---|
| SMILES | CCOC(=O)C1=C(NN=C1)N=C2CCCCCN2C |
Product Overview
ethyl 5-[(1-methylazepan-2-ylidene)amino]-1H-pyrazole-4-carboxylate (CAS 66751-73-3), with molecular formula C13H20N4O2 and molecular weight 264.16 g/mol. IUPAC: ethyl 5-[(1-methylazepan-2-ylidene)amino]-1H-pyrazole-4-carboxylate.
Chemical Property Profile of ethyl 5-[(1-methylazepan-2-ylidene)amino]-1H-pyrazole-4-carboxylate
Property Insights of ethyl 5-[(1-methylazepan-2-ylidene)amino]-1H-pyrazole-4-carboxylate
The XLogP value of 2.1222 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ethyl 5-[(1-methylazepan-2-ylidene)amino]-1H-pyrazole-4-carboxylate. The TPSA of 70.58 Ų falls within the moderate polarity range, balancing permeability and solubility for ethyl 5-[(1-methylazepan-2-ylidene)amino]-1H-pyrazole-4-carboxylate. Following Lipinski's Rule of Five, ethyl 5-[(1-methylazepan-2-ylidene)amino]-1H-pyrazole-4-carboxylate 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 ethyl 5-[(1-methylazepan-2-ylidene)amino]-1H-pyrazole-4-carboxylate?
The CAS number of ethyl 5-[(1-methylazepan-2-ylidene)amino]-1H-pyrazole-4-carboxylate is 66751-73-3.
What is the molecular formula of ethyl 5-[(1-methylazepan-2-ylidene)amino]-1H-pyrazole-4-carboxylate?
The molecular formula of ethyl 5-[(1-methylazepan-2-ylidene)amino]-1H-pyrazole-4-carboxylate is C13H20N4O2.
What is the molecular weight of ethyl 5-[(1-methylazepan-2-ylidene)amino]-1H-pyrazole-4-carboxylate?
The molecular weight of ethyl 5-[(1-methylazepan-2-ylidene)amino]-1H-pyrazole-4-carboxylate is 264.16 g/mol.
Where can I buy ethyl 5-[(1-methylazepan-2-ylidene)amino]-1H-pyrazole-4-carboxylate?
You can request a quote for ethyl 5-[(1-methylazepan-2-ylidene)amino]-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 ethyl 5-[(1-methylazepan-2-ylidene)amino]-1H-pyrazole-4-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for ethyl 5-[(1-methylazepan-2-ylidene)amino]-1H-pyrazole-4-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.