KST-1A2296
TL;DR: KST-1A2296 (CAS 18819-66-4) is a chemical compound with molecular formula C14H12F3N3O4 and molecular weight 343.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(6R)-2-nitro-6-[[4-(trifluoromethyl)phenyl]methoxy]-6,7-dihydro-5H-imidazo[2,1-b][1,3]oxazine
Also Known As: KST-1A2296, (6r)-2-nitro-6-{[4-(trifluoromethyl)benzyl]oxy}-6,7-dihydro-5h-imidazo[2,1-b][1,3]oxazine, (R)-2-Nitro-6-(4-trifluoromethylbenzyloxy)-6,7-dihydro-5H-imidazo(2,1-b)(1,3)oxazine', (R)-2-Nitro-6-((4-(trifluoromethyl)benzyl)oxy)-6,7-dihydro-5H-imidazo[2,1-b][1,3]oxazine, (6R)-2-nitro-6-[[4-(trifluoromethyl)phenyl]methoxy]-6,7-dihydro-5H-imidazo[2,1-b][1,3]oxazine
| Molecular Formula | C14H12F3N3O4 |
|---|---|
| Molecular Weight | 343.08 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 82.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 3 |
| Exact Mass | 343.078 |
| Heavy Atoms | 24 |
| Complexity | 452.0 |
Chemical Identifiers
| CAS Number | 18819-66-4 |
|---|---|
| SMILES | C1[C@H](COC2=NC(=CN21)[N+](=O)[O-])OCC3=CC=C(C=C3)C(F)(F)F |
| InChIKey | SGJBPETWYLMWNC-LLVKDONJSA-N |
Product Overview
KST-1A2296 (CAS 18819-66-4), with molecular formula C14H12F3N3O4 and molecular weight 343.08 g/mol. IUPAC: (6R)-2-nitro-6-[[4-(trifluoromethyl)phenyl]methoxy]-6,7-dihydro-5H-imidazo[2,1-b][1,3]oxazine.
Chemical Property Profile of KST-1A2296
Property Insights of KST-1A2296
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for KST-1A2296. The TPSA of 82.1 Ų falls within the moderate polarity range, balancing permeability and solubility for KST-1A2296. Following Lipinski's Rule of Five, KST-1A2296 has 0 hydrogen bond donor(s) and 8 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 KST-1A2296?
The CAS number of KST-1A2296 is 18819-66-4.
What is the molecular formula of KST-1A2296?
The molecular formula of KST-1A2296 is C14H12F3N3O4.
What is the molecular weight of KST-1A2296?
The molecular weight of KST-1A2296 is 343.08 g/mol.
Where can I buy KST-1A2296?
You can request a quote for KST-1A2296 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for KST-1A2296?
Yes, KEHONG BIO provides custom synthesis services for KST-1A2296 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.