Ethyl 5-methyl-1,3-diphenyl-1H-pyrazole-4-carboxylate
TL;DR: Ethyl 5-methyl-1,3-diphenyl-1H-pyrazole-4-carboxylate (CAS 7189-04-0) is a chemical compound with molecular formula C19H18N2O2 and molecular weight 306.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 5-methyl-1,3-diphenylpyrazole-4-carboxylate
Also Known As: ethyl 5-methyl-1,3-diphenylpyrazole-4-carboxylate, 5-METHYL-1,3-DIPHENYL-1H-PYRAZOLE-4-CARBOXYLIC ACID ETHYL ESTER, ethyl 5-methyl-1,3-diphenyl-1H-pyrazole-4-carboxylate, BIM-0004895.P001, J2.672.067B
| Molecular Formula | C19H18N2O2 |
|---|---|
| Molecular Weight | 306.14 g/mol |
| LogP | 4.2 |
| Topological Polar Surface Area | 44.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 306.13684 |
| Heavy Atoms | 23 |
| Complexity | 389.0 |
Chemical Identifiers
| CAS Number | 7189-04-0 |
|---|---|
| SMILES | CCOC(=O)C1=C(N(N=C1C2=CC=CC=C2)C3=CC=CC=C3)C |
| InChIKey | VCPCQJHHHVITQW-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Ethyl 5-methyl-1,3-diphenyl-1H-pyrazole-4-carboxylate (CAS 7189-04-0), with molecular formula C19H18N2O2 and molecular weight 306.14 g/mol. IUPAC: ethyl 5-methyl-1,3-diphenylpyrazole-4-carboxylate.
Chemical Property Profile of Ethyl 5-methyl-1,3-diphenyl-1H-pyrazole-4-carboxylate
Property Insights of Ethyl 5-methyl-1,3-diphenyl-1H-pyrazole-4-carboxylate
The XLogP value of 4.2 indicates that Ethyl 5-methyl-1,3-diphenyl-1H-pyrazole-4-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 44.1 Ų, Ethyl 5-methyl-1,3-diphenyl-1H-pyrazole-4-carboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl 5-methyl-1,3-diphenyl-1H-pyrazole-4-carboxylate has 0 hydrogen bond donor(s) and 3 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-methyl-1,3-diphenyl-1H-pyrazole-4-carboxylate?
The CAS number of Ethyl 5-methyl-1,3-diphenyl-1H-pyrazole-4-carboxylate is 7189-04-0.
What is the molecular formula of Ethyl 5-methyl-1,3-diphenyl-1H-pyrazole-4-carboxylate?
The molecular formula of Ethyl 5-methyl-1,3-diphenyl-1H-pyrazole-4-carboxylate is C19H18N2O2.
What is the molecular weight of Ethyl 5-methyl-1,3-diphenyl-1H-pyrazole-4-carboxylate?
The molecular weight of Ethyl 5-methyl-1,3-diphenyl-1H-pyrazole-4-carboxylate is 306.14 g/mol.
Where can I buy Ethyl 5-methyl-1,3-diphenyl-1H-pyrazole-4-carboxylate?
You can request a quote for Ethyl 5-methyl-1,3-diphenyl-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-methyl-1,3-diphenyl-1H-pyrazole-4-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 5-methyl-1,3-diphenyl-1H-pyrazole-4-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.