TL;DR: 4-Isoxazolecarboxamide, 3,5-dimethyl-N-[4-[(1E)-2-phenyldiazenyl]phenyl]- (CAS 1003469-43-9) is a chemical compound with molecular formula C18H16N4O2 and molecular weight 320.12732 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3,5-dimethyl-N-(4-phenyldiazenylphenyl)-1,2-oxazole-4-carboxamide
Also Known As: 4-Isoxazolecarboxamide, 3,5-dimethyl-N-[4-[(1E)-2-phenyldiazenyl]phenyl]-, 3,5-dimethyl-N-(4-phenyldiazenylphenyl)-1,2-oxazole-4-carboxamide
| Molecular Formula | C18H16N4O2 |
| Molecular Weight | 320.12732 g/mol |
| XLogP | 3.8 |
| Topological Polar Surface Area (TPSA) | 79.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 320.12732 Da |
| Heavy Atoms | 24 |
| Complexity | 442.0 |
| SMILES | CC1=C(C(=NO1)C)C(=O)NC2=CC=C(C=C2)N=NC3=CC=CC=C3 |
| InChIKey | PDTFRJOWDYKJRH-UHFFFAOYSA-N |
The XLogP value of 3.8 indicates that 4-Isoxazolecarboxamide, 3,5-dimethyl-N-[4-[(1E)-2-phenyldiazenyl]phenyl]- 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 4-Isoxazolecarboxamide, 3,5-dimethyl-N-[4-[(1E)-2-phenyldiazenyl]phenyl]-. Following Lipinski's Rule of Five, 4-Isoxazolecarboxamide, 3,5-dimethyl-N-[4-[(1E)-2-phenyldiazenyl]phenyl]- has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 4-Isoxazolecarboxamide, 3,5-dimethyl-N-[4-[(1E)-2-phenyldiazenyl]phenyl]- is 1003469-43-9.
The molecular formula of 4-Isoxazolecarboxamide, 3,5-dimethyl-N-[4-[(1E)-2-phenyldiazenyl]phenyl]- is C18H16N4O2.
The molecular weight of 4-Isoxazolecarboxamide, 3,5-dimethyl-N-[4-[(1E)-2-phenyldiazenyl]phenyl]- is 320.12732 g/mol.
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