(4R,5S)-4-nitro-5-(4-nitrophenyl)-3-phenyl-4,5-dihydro-1,2-oxazole
TL;DR: (4R,5S)-4-nitro-5-(4-nitrophenyl)-3-phenyl-4,5-dihydro-1,2-oxazole (CAS 130966-48-2) is a chemical compound with molecular formula C15H11N3O5 and molecular weight 313.0699 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(4R,5S)-4-nitro-5-(4-nitrophenyl)-3-phenyl-4,5-dihydro-1,2-oxazole
Also Known As: (4R,5S)-4-nitro-5-(4-nitrophenyl)-3-phenyl-4,5-dihydro-1,2-oxazole, rel-(4R,5S)-4,5-Dihydro-4-nitro-5-(4-nitrophenyl)-3-phenylisoxazole
Technical Specifications
| Molecular Formula | C15H11N3O5 |
| Molecular Weight | 313.0699 g/mol |
| XLogP | 3.2 |
| Topological Polar Surface Area (TPSA) | 113.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 313.0699 Da |
| Heavy Atoms | 23 |
| Complexity | 484.0 |
| SMILES | C1=CC=C(C=C1)C2=NO[C@H]([C@@H]2[N+](=O)[O-])C3=CC=C(C=C3)[N+](=O)[O-] |
| InChIKey | HLCKDFGBHDBICY-CABCVRRESA-N |
Chemical Property Profile of (4R,5S)-4-nitro-5-(4-nitrophenyl)-3-phenyl-4,5-dihydro-1,2-oxazole
Property Insights of (4R,5S)-4-nitro-5-(4-nitrophenyl)-3-phenyl-4,5-dihydro-1,2-oxazole
The XLogP value of 3.2 indicates that (4R,5S)-4-nitro-5-(4-nitrophenyl)-3-phenyl-4,5-dihydro-1,2-oxazole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 113.0 Ų falls within the moderate polarity range, balancing permeability and solubility for (4R,5S)-4-nitro-5-(4-nitrophenyl)-3-phenyl-4,5-dihydro-1,2-oxazole. Following Lipinski's Rule of Five, (4R,5S)-4-nitro-5-(4-nitrophenyl)-3-phenyl-4,5-dihydro-1,2-oxazole 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
What is the CAS number of (4R,5S)-4-nitro-5-(4-nitrophenyl)-3-phenyl-4,5-dihydro-1,2-oxazole?
The CAS number of (4R,5S)-4-nitro-5-(4-nitrophenyl)-3-phenyl-4,5-dihydro-1,2-oxazole is 130966-48-2.
What is the molecular formula of (4R,5S)-4-nitro-5-(4-nitrophenyl)-3-phenyl-4,5-dihydro-1,2-oxazole?
The molecular formula of (4R,5S)-4-nitro-5-(4-nitrophenyl)-3-phenyl-4,5-dihydro-1,2-oxazole is C15H11N3O5.
What is the molecular weight of (4R,5S)-4-nitro-5-(4-nitrophenyl)-3-phenyl-4,5-dihydro-1,2-oxazole?
The molecular weight of (4R,5S)-4-nitro-5-(4-nitrophenyl)-3-phenyl-4,5-dihydro-1,2-oxazole is 313.0699 g/mol.
Where can I buy (4R,5S)-4-nitro-5-(4-nitrophenyl)-3-phenyl-4,5-dihydro-1,2-oxazole?
You can request a quote for (4R,5S)-4-nitro-5-(4-nitrophenyl)-3-phenyl-4,5-dihydro-1,2-oxazole directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for (4R,5S)-4-nitro-5-(4-nitrophenyl)-3-phenyl-4,5-dihydro-1,2-oxazole?
Yes, CoreyChem provides custom synthesis services for (4R,5S)-4-nitro-5-(4-nitrophenyl)-3-phenyl-4,5-dihydro-1,2-oxazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.