ChemDiv1_022730
TL;DR: ChemDiv1_022730 (CAS 35929-95-4) is a chemical compound with molecular formula C22H18N2O5 and molecular weight 390.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-methyl-4-(4-nitrophenyl)-5-oxo-1,4-dihydroindeno[1,2-b]pyridine-3-carboxylate
Also Known As: ChemDiv1_022730, DivK1c_003994, CDS1_002954, BAS 01520517, BIM-0041548.P001
| Molecular Formula | C22H18N2O5 |
|---|---|
| Molecular Weight | 390.12 g/mol |
| LogP | 3.7263 |
| Topological Polar Surface Area | 98.54 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 390.12158 |
| Heavy Atoms | 29 |
| Complexity | 1112.2775 |
Chemical Identifiers
| CAS Number | 35929-95-4 |
|---|---|
| SMILES | CCOC(=O)C1=C(NC2=C(C1C3=CC=C(C=C3)[N+](=O)[O-])C(=O)C4=CC=CC=C42)C |
Product Overview
ChemDiv1_022730 (CAS 35929-95-4), with molecular formula C22H18N2O5 and molecular weight 390.12 g/mol. IUPAC: ethyl 2-methyl-4-(4-nitrophenyl)-5-oxo-1,4-dihydroindeno[1,2-b]pyridine-3-carboxylate.
Chemical Property Profile of ChemDiv1_022730
Property Insights of ChemDiv1_022730
The XLogP value of 3.7263 indicates that ChemDiv1_022730 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 98.54 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv1_022730. Following Lipinski's Rule of Five, ChemDiv1_022730 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_022730?
The CAS number of ChemDiv1_022730 is 35929-95-4.
What is the molecular formula of ChemDiv1_022730?
The molecular formula of ChemDiv1_022730 is C22H18N2O5.
What is the molecular weight of ChemDiv1_022730?
The molecular weight of ChemDiv1_022730 is 390.12 g/mol.
Where can I buy ChemDiv1_022730?
You can request a quote for ChemDiv1_022730 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_022730?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_022730 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.