ChemDiv1_020423
TL;DR: ChemDiv1_020423 (CAS 328540-49-4) is a chemical compound with molecular formula C23H23N5O3 and molecular weight 417.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1E)-1-[(4-nitrophenyl)methylidene]-4-(2-piperidin-1-ylethyl)imidazo[1,2-a]benzimidazol-2-one
Also Known As: ChemDiv1_020423, (E)-3-(4-nitrobenzylidene)-9-(2-(piperidin-1-yl)ethyl)-3,9-dihydro-2H-benzo[d]imidazo[1,2-a]imidazol-2-one, (1E)-1-[(4-nitrophenyl)methylidene]-4-(2-piperidin-1-ylethyl)imidazo[1,2-a]benzimidazol-2-one, (3E)-3-(4-nitrobenzylidene)-9-[2-(piperidin-1-yl)ethyl]-3H-imidazo[1,2-a]benzimidazol-2(9H)-one, 3-[1-(4-Nitro-phenyl)-meth-(E)-ylidene]-9-(2-piperidin-1-yl-ethyl)-9H-benzo[d]imidazo[1,2-a]imidazol-2-o ne
| Molecular Formula | C23H23N5O3 |
|---|---|
| Molecular Weight | 417.18 g/mol |
| LogP | 3.6444 |
| Topological Polar Surface Area | 82.29 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 417.18008 |
| Heavy Atoms | 31 |
| Complexity | 1086.6458 |
Chemical Identifiers
| CAS Number | 328540-49-4 |
|---|---|
| SMILES | C1CCN(CC1)CCN2C3=CC=CC=C3N\4C2=NC(=O)/C4=C\C5=CC=C(C=C5)[N+](=O)[O-] |
Product Overview
ChemDiv1_020423 (CAS 328540-49-4), with molecular formula C23H23N5O3 and molecular weight 417.18 g/mol. IUPAC: (1E)-1-[(4-nitrophenyl)methylidene]-4-(2-piperidin-1-ylethyl)imidazo[1,2-a]benzimidazol-2-one.
Chemical Property Profile of ChemDiv1_020423
Property Insights of ChemDiv1_020423
The XLogP value of 3.6444 indicates that ChemDiv1_020423 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 82.29 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv1_020423. Following Lipinski's Rule of Five, ChemDiv1_020423 has 0 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_020423?
The CAS number of ChemDiv1_020423 is 328540-49-4.
What is the molecular formula of ChemDiv1_020423?
The molecular formula of ChemDiv1_020423 is C23H23N5O3.
What is the molecular weight of ChemDiv1_020423?
The molecular weight of ChemDiv1_020423 is 417.18 g/mol.
Where can I buy ChemDiv1_020423?
You can request a quote for ChemDiv1_020423 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_020423?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_020423 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.