ethyl 2-(3,5-dimethyl-1H-pyrazol-1-yl)-4-((2-((2,4-dimethylphenyl)carbamoyl)phenyl)amino)pyrimidine-5-carboxylate
TL;DR: ethyl 2-(3,5-dimethyl-1H-pyrazol-1-yl)-4-((2-((2,4-dimethylphenyl)carbamoyl)phenyl)amino)pyrimidine-5-carboxylate (CAS 1009188-35-5) is a chemical compound with molecular formula C27H28N6O3 and molecular weight 484.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-[2-[(2,4-dimethylphenyl)carbamoyl]anilino]-2-(3,5-dimethylpyrazol-1-yl)pyrimidine-5-carboxylate
Also Known As: ethyl 2-(3,5-dimethyl-1H-pyrazol-1-yl)-4-((2-((2,4-dimethylphenyl)carbamoyl)phenyl)amino)pyrimidine-5-carboxylate, ethyl 4-({2-[(2,4-dimethylphenyl)carbamoyl]phenyl}amino)-2-(3,5-dimethyl-1H-pyrazol-1-yl)pyrimidine-5-carboxylate, ethyl 4-[2-[(2,4-dimethylphenyl)carbamoyl]anilino]-2-(3,5-dimethylpyrazol-1-yl)pyrimidine-5-carboxylate
| Molecular Formula | C27H28N6O3 |
|---|---|
| Molecular Weight | 484.22 g/mol |
| LogP | 5.06858 |
| Topological Polar Surface Area | 111.03 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 484.2223 |
| Heavy Atoms | 36 |
| Complexity | 1443.4521 |
Chemical Identifiers
| CAS Number | 1009188-35-5 |
|---|---|
| SMILES | CCOC(=O)C1=CN=C(N=C1NC2=CC=CC=C2C(=O)NC3=C(C=C(C=C3)C)C)N4C(=CC(=N4)C)C |
Product Overview
ethyl 2-(3,5-dimethyl-1H-pyrazol-1-yl)-4-((2-((2,4-dimethylphenyl)carbamoyl)phenyl)amino)pyrimidine-5-carboxylate (CAS 1009188-35-5), with molecular formula C27H28N6O3 and molecular weight 484.22 g/mol. IUPAC: ethyl 4-[2-[(2,4-dimethylphenyl)carbamoyl]anilino]-2-(3,5-dimethylpyrazol-1-yl)pyrimidine-5-carboxylate.
Chemical Property Profile of ethyl 2-(3,5-dimethyl-1H-pyrazol-1-yl)-4-((2-((2,4-dimethylphenyl)carbamoyl)phenyl)amino)pyrimidine-5-carboxylate
Property Insights of ethyl 2-(3,5-dimethyl-1H-pyrazol-1-yl)-4-((2-((2,4-dimethylphenyl)carbamoyl)phenyl)amino)pyrimidine-5-carboxylate
The XLogP value of 5.06858 indicates that ethyl 2-(3,5-dimethyl-1H-pyrazol-1-yl)-4-((2-((2,4-dimethylphenyl)carbamoyl)phenyl)amino)pyrimidine-5-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 111.03 Ų falls within the moderate polarity range, balancing permeability and solubility for ethyl 2-(3,5-dimethyl-1H-pyrazol-1-yl)-4-((2-((2,4-dimethylphenyl)carbamoyl)phenyl)amino)pyrimidine-5-carboxylate. Following Lipinski's Rule of Five, ethyl 2-(3,5-dimethyl-1H-pyrazol-1-yl)-4-((2-((2,4-dimethylphenyl)carbamoyl)phenyl)amino)pyrimidine-5-carboxylate has 2 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of ethyl 2-(3,5-dimethyl-1H-pyrazol-1-yl)-4-((2-((2,4-dimethylphenyl)carbamoyl)phenyl)amino)pyrimidine-5-carboxylate?
The CAS number of ethyl 2-(3,5-dimethyl-1H-pyrazol-1-yl)-4-((2-((2,4-dimethylphenyl)carbamoyl)phenyl)amino)pyrimidine-5-carboxylate is 1009188-35-5.
What is the molecular formula of ethyl 2-(3,5-dimethyl-1H-pyrazol-1-yl)-4-((2-((2,4-dimethylphenyl)carbamoyl)phenyl)amino)pyrimidine-5-carboxylate?
The molecular formula of ethyl 2-(3,5-dimethyl-1H-pyrazol-1-yl)-4-((2-((2,4-dimethylphenyl)carbamoyl)phenyl)amino)pyrimidine-5-carboxylate is C27H28N6O3.
What is the molecular weight of ethyl 2-(3,5-dimethyl-1H-pyrazol-1-yl)-4-((2-((2,4-dimethylphenyl)carbamoyl)phenyl)amino)pyrimidine-5-carboxylate?
The molecular weight of ethyl 2-(3,5-dimethyl-1H-pyrazol-1-yl)-4-((2-((2,4-dimethylphenyl)carbamoyl)phenyl)amino)pyrimidine-5-carboxylate is 484.22 g/mol.
Where can I buy ethyl 2-(3,5-dimethyl-1H-pyrazol-1-yl)-4-((2-((2,4-dimethylphenyl)carbamoyl)phenyl)amino)pyrimidine-5-carboxylate?
You can request a quote for ethyl 2-(3,5-dimethyl-1H-pyrazol-1-yl)-4-((2-((2,4-dimethylphenyl)carbamoyl)phenyl)amino)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-(3,5-dimethyl-1H-pyrazol-1-yl)-4-((2-((2,4-dimethylphenyl)carbamoyl)phenyl)amino)pyrimidine-5-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for ethyl 2-(3,5-dimethyl-1H-pyrazol-1-yl)-4-((2-((2,4-dimethylphenyl)carbamoyl)phenyl)amino)pyrimidine-5-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.