Fexinidazole
1-methyl-2-[(4-methylsulfanylphenoxy)methyl]-5-nitroimidazole
| Molecular Formula | C12H13N3O3S |
|---|---|
| Molecular Weight | 279.32 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 98.2 A2 |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 279.06775 |
| Heavy Atoms | 19 |
| Complexity | 305.0 |
Chemical Identifiers
| CAS Number | 59729-37-2 |
|---|---|
| SMILES | CN1C(=CN=C1COC2=CC=C(C=C2)SC)[N+](=O)[O-] |
| InChIKey | MIWWSGDADVMLTG-UHFFFAOYSA-N |
📖 Product Overview
Fexinidazole (CAS: 59729-37-2) is a chemical compound with molecular formula C12H13N3O3S and molecular weight 279.32 g/mol. Its IUPAC systematic name is 1-methyl-2-[(4-methylsulfanylphenoxy)methyl]-5-nitroimidazole.
MIWWSGDADVMLTG-UHFFFAOYSA-N.
SMILES: CN1C(=CN=C1COC2=CC=C(C=C2)SC)[N+](=O)[O-].
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