RefChem:1072002
TL;DR: RefChem:1072002 (CAS 126245-14-5) is a chemical compound with molecular formula C23H15BrN4O3 and molecular weight 474.03275 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(5Z)-5-[(4-bromophenyl)methylidene]-3-[(E)-(2-nitrophenyl)methylideneamino]-2-phenylimidazol-4-one
Also Known As: 4-(p-Bromobenzylidene)-1-((o-nitrobenzylidene)amino)-2-phenyl-2-imidazolin-5-one, 4H-Imidazol-4-one, 3,5-dihydro-5-((4-bromophenyl)methylene)-3-(((2-nitrophenyl)methylene)amino)-2-phenyl-, 2-Imidazolin-5-one, 4-(p-bromobenzylidene)-1-((o-nitrobenzylidene)amino)-2-phenyl-
Technical Specifications
| Molecular Formula | C23H15BrN4O3 |
| Molecular Weight | 474.03275 g/mol |
| XLogP | 5.3 |
| Topological Polar Surface Area (TPSA) | 90.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 474.03275 Da |
| Heavy Atoms | 31 |
| Complexity | 761.0 |
| SMILES | C1=CC=C(C=C1)C2=N/C(=C\C3=CC=C(C=C3)Br)/C(=O)N2/N=C/C4=CC=CC=C4[N+](=O)[O-] |
| InChIKey | GLXFLBBHDGJXPN-KLINPMNRSA-N |
Chemical Property Profile of RefChem:1072002
Property Insights of RefChem:1072002
The XLogP value of 5.3 indicates that RefChem:1072002 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 90.9 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:1072002. Following Lipinski's Rule of Five, RefChem:1072002 has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of RefChem:1072002?
The CAS number of RefChem:1072002 is 126245-14-5.
What is the molecular formula of RefChem:1072002?
The molecular formula of RefChem:1072002 is C23H15BrN4O3.
What is the molecular weight of RefChem:1072002?
The molecular weight of RefChem:1072002 is 474.03275 g/mol.
Where can I buy RefChem:1072002?
You can request a quote for RefChem:1072002 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for RefChem:1072002?
Yes, CoreyChem provides custom synthesis services for RefChem:1072002 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.