TL;DR: Phox-I1 (CAS 1388151-90-3) is a chemical compound with molecular formula C23H19N3O4 and molecular weight 401.13754 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
9-methoxy-5-(3-nitrophenyl)-2-phenyl-5,10b-dihydro-1H-pyrazolo[1,5-c][1,3]benzoxazine
Also Known As: Phox-I1, 9-methoxy-5-(3-nitrophenyl)-2-phenyl-5,10b-dihydro-1H-pyrazolo[1,5-c][1,3]benzoxazine, F0889-0161, 9-methoxy-5-(3-nitrophenyl)-2-phenyl-1,10b-dihydro-5H-benzo[e]pyrazolo[1,5-c][1,3]oxazine, 1,10b-Dihydro-9-methoxy-5-(3-nitrophenyl)-2-phenyl-5H-pyrazolo[1,5-c][1,3]benzoxazine
| Molecular Formula | C23H19N3O4 |
| Molecular Weight | 401.13754 g/mol |
| XLogP | 4.6 |
| Topological Polar Surface Area (TPSA) | 79.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 401.13754 Da |
| Heavy Atoms | 30 |
| Complexity | 659.0 |
| SMILES | COC1=CC2=C(C=C1)OC(N3C2CC(=N3)C4=CC=CC=C4)C5=CC(=CC=C5)[N+](=O)[O-] |
| InChIKey | VTKZDTUTWZFSRQ-UHFFFAOYSA-N |
The XLogP value of 4.6 indicates that Phox-I1 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 79.9 Ų falls within the moderate polarity range, balancing permeability and solubility for Phox-I1. Following Lipinski's Rule of Five, Phox-I1 has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Phox-I1 is 1388151-90-3.
The molecular formula of Phox-I1 is C23H19N3O4.
The molecular weight of Phox-I1 is 401.13754 g/mol.
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