ChemDiv1_026015
TL;DR: ChemDiv1_026015 (CAS 496809-37-1) is a chemical compound with molecular formula C22H24N2O4 and molecular weight 380.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-(4-ethoxyanilino)-2-methyl-5-oxo-1-phenylpyrrole-2-carboxylate
Also Known As: ChemDiv1_026015, A1904/0079988, ethyl 4-[(4-ethoxyphenyl)amino]-2-methyl-5-oxo-1-phenyl-2,5-dihydro-1H-pyrrole-2-carboxylate, Ethyl 4-(4-ethoxyanilino)-2-methyl-5-oxo-1-phenyl-2,5-dihydro-1H-pyrrole-2-carboxylate, ethyl 4-(4-ethoxyanilino)-2-methyl-5-oxo-1-phenylpyrrole-2-carboxylate
| Molecular Formula | C22H24N2O4 |
|---|---|
| Molecular Weight | 380.17 g/mol |
| LogP | 3.7497 |
| Topological Polar Surface Area | 67.87 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 380.1736 |
| Heavy Atoms | 28 |
| Complexity | 877.16956 |
Chemical Identifiers
| CAS Number | 496809-37-1 |
|---|---|
| SMILES | CCOC1=CC=C(C=C1)NC2=CC(N(C2=O)C3=CC=CC=C3)(C)C(=O)OCC |
Product Overview
ChemDiv1_026015 (CAS 496809-37-1), with molecular formula C22H24N2O4 and molecular weight 380.17 g/mol. IUPAC: ethyl 4-(4-ethoxyanilino)-2-methyl-5-oxo-1-phenylpyrrole-2-carboxylate.
Chemical Property Profile of ChemDiv1_026015
Property Insights of ChemDiv1_026015
The XLogP value of 3.7497 indicates that ChemDiv1_026015 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 67.87 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv1_026015. Following Lipinski's Rule of Five, ChemDiv1_026015 has 1 hydrogen bond donor(s) and 5 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 ChemDiv1_026015?
The CAS number of ChemDiv1_026015 is 496809-37-1.
What is the molecular formula of ChemDiv1_026015?
The molecular formula of ChemDiv1_026015 is C22H24N2O4.
What is the molecular weight of ChemDiv1_026015?
The molecular weight of ChemDiv1_026015 is 380.17 g/mol.
Where can I buy ChemDiv1_026015?
You can request a quote for ChemDiv1_026015 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_026015?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_026015 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.