ethyl 2-(4-methyl-1H-pyrazol-1-yl)-4-(4-phenylpiperazin-1-yl)pyrimidine-5-carboxylate
TL;DR: ethyl 2-(4-methyl-1H-pyrazol-1-yl)-4-(4-phenylpiperazin-1-yl)pyrimidine-5-carboxylate (CAS 1002414-72-3) is a chemical compound with molecular formula C21H24N6O2 and molecular weight 392.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-(4-methylpyrazol-1-yl)-4-(4-phenylpiperazin-1-yl)pyrimidine-5-carboxylate
Also Known As: ethyl 2-(4-methyl-1H-pyrazol-1-yl)-4-(4-phenylpiperazin-1-yl)pyrimidine-5-carboxylate, ethyl 2-(4-methylpyrazol-1-yl)-4-(4-phenylpiperazin-1-yl)pyrimidine-5-carboxylate
| Molecular Formula | C21H24N6O2 |
|---|---|
| Molecular Weight | 392.20 g/mol |
| LogP | 2.47402 |
| Topological Polar Surface Area | 76.38 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 392.19608 |
| Heavy Atoms | 29 |
| Complexity | 979.8462 |
Chemical Identifiers
| CAS Number | 1002414-72-3 |
|---|---|
| SMILES | CCOC(=O)C1=CN=C(N=C1N2CCN(CC2)C3=CC=CC=C3)N4C=C(C=N4)C |
Product Overview
ethyl 2-(4-methyl-1H-pyrazol-1-yl)-4-(4-phenylpiperazin-1-yl)pyrimidine-5-carboxylate (CAS 1002414-72-3), with molecular formula C21H24N6O2 and molecular weight 392.20 g/mol. IUPAC: ethyl 2-(4-methylpyrazol-1-yl)-4-(4-phenylpiperazin-1-yl)pyrimidine-5-carboxylate.
Chemical Property Profile of ethyl 2-(4-methyl-1H-pyrazol-1-yl)-4-(4-phenylpiperazin-1-yl)pyrimidine-5-carboxylate
Property Insights of ethyl 2-(4-methyl-1H-pyrazol-1-yl)-4-(4-phenylpiperazin-1-yl)pyrimidine-5-carboxylate
The XLogP value of 2.47402 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ethyl 2-(4-methyl-1H-pyrazol-1-yl)-4-(4-phenylpiperazin-1-yl)pyrimidine-5-carboxylate. The TPSA of 76.38 Ų falls within the moderate polarity range, balancing permeability and solubility for ethyl 2-(4-methyl-1H-pyrazol-1-yl)-4-(4-phenylpiperazin-1-yl)pyrimidine-5-carboxylate. Following Lipinski's Rule of Five, ethyl 2-(4-methyl-1H-pyrazol-1-yl)-4-(4-phenylpiperazin-1-yl)pyrimidine-5-carboxylate has 0 hydrogen bond donor(s) and 7 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 2-(4-methyl-1H-pyrazol-1-yl)-4-(4-phenylpiperazin-1-yl)pyrimidine-5-carboxylate?
The CAS number of ethyl 2-(4-methyl-1H-pyrazol-1-yl)-4-(4-phenylpiperazin-1-yl)pyrimidine-5-carboxylate is 1002414-72-3.
What is the molecular formula of ethyl 2-(4-methyl-1H-pyrazol-1-yl)-4-(4-phenylpiperazin-1-yl)pyrimidine-5-carboxylate?
The molecular formula of ethyl 2-(4-methyl-1H-pyrazol-1-yl)-4-(4-phenylpiperazin-1-yl)pyrimidine-5-carboxylate is C21H24N6O2.
What is the molecular weight of ethyl 2-(4-methyl-1H-pyrazol-1-yl)-4-(4-phenylpiperazin-1-yl)pyrimidine-5-carboxylate?
The molecular weight of ethyl 2-(4-methyl-1H-pyrazol-1-yl)-4-(4-phenylpiperazin-1-yl)pyrimidine-5-carboxylate is 392.20 g/mol.
Where can I buy ethyl 2-(4-methyl-1H-pyrazol-1-yl)-4-(4-phenylpiperazin-1-yl)pyrimidine-5-carboxylate?
You can request a quote for ethyl 2-(4-methyl-1H-pyrazol-1-yl)-4-(4-phenylpiperazin-1-yl)pyrimidine-5-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ethyl 2-(4-methyl-1H-pyrazol-1-yl)-4-(4-phenylpiperazin-1-yl)pyrimidine-5-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for ethyl 2-(4-methyl-1H-pyrazol-1-yl)-4-(4-phenylpiperazin-1-yl)pyrimidine-5-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.