ChemDiv1_025617
TL;DR: ChemDiv1_025617 (CAS 496789-86-7) is a chemical compound with molecular formula C24H24N2O5 and molecular weight 420.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-(4-acetylanilino)-1-(4-acetylphenyl)-2-methyl-5-oxopyrrole-2-carboxylate
Also Known As: ChemDiv1_025617, AB01312122-01, ethyl 1-(4-acetylphenyl)-4-[(4-acetylphenyl)amino]-2-methyl-5-oxo-2,5-dihydro-1H-pyrrole-2-carboxylate, ethyl 4-(4-acetylanilino)-1-(4-acetylphenyl)-2-methyl-5-oxopyrrole-2-carboxylate, ethyl 1-(4-acetylphenyl)-4-((4-acetylphenyl)amino)-2-methyl-5-oxo-2,5-dihydro-1H-pyrrole-2-carboxylate
| Molecular Formula | C24H24N2O5 |
|---|---|
| Molecular Weight | 420.17 g/mol |
| LogP | 3.7562 |
| Topological Polar Surface Area | 92.78 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 420.16852 |
| Heavy Atoms | 31 |
| Complexity | 1070.1534 |
Chemical Identifiers
| CAS Number | 496789-86-7 |
|---|---|
| SMILES | CCOC(=O)C1(C=C(C(=O)N1C2=CC=C(C=C2)C(=O)C)NC3=CC=C(C=C3)C(=O)C)C |
Product Overview
ChemDiv1_025617 (CAS 496789-86-7), with molecular formula C24H24N2O5 and molecular weight 420.17 g/mol. IUPAC: ethyl 4-(4-acetylanilino)-1-(4-acetylphenyl)-2-methyl-5-oxopyrrole-2-carboxylate.
Chemical Property Profile of ChemDiv1_025617
Property Insights of ChemDiv1_025617
The XLogP value of 3.7562 indicates that ChemDiv1_025617 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 92.78 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv1_025617. Following Lipinski's Rule of Five, ChemDiv1_025617 has 1 hydrogen bond donor(s) and 6 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_025617?
The CAS number of ChemDiv1_025617 is 496789-86-7.
What is the molecular formula of ChemDiv1_025617?
The molecular formula of ChemDiv1_025617 is C24H24N2O5.
What is the molecular weight of ChemDiv1_025617?
The molecular weight of ChemDiv1_025617 is 420.17 g/mol.
Where can I buy ChemDiv1_025617?
You can request a quote for ChemDiv1_025617 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_025617?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_025617 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.