99362-10-4 Purity
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Specification
The molecular formula of sertaconazole nitrate is C20H16Cl3N3O4S.
The molecular weight of sertaconazole nitrate is 500.8 g/mol.
The IUPAC name of sertaconazole nitrate is 1-[2-[(7-chloro-1-benzothiophen-3-yl)methoxy]-2-(2,4-dichlorophenyl)ethyl]imidazole; nitric acid.
Sertaconazole nitrate inhibits fungal cytochrome P-450 sterol C-14 alpha-demethylation, leading to the accumulation of fungal 14 alpha-methyl sterols and inhibition of ergosterol synthesis in fungal cells.
The InChIKey of sertaconazole nitrate is HAAITRDZHUANGT-UHFFFAOYSA-N.
The canonical SMILES representation of sertaconazole nitrate is C1=CC2=C(C(=C1)Cl)SC=C2COC(CN3C=CN=C3)C4=C(C=C(C=C4)Cl)Cl.[N+](=O)(O)[O-].
The CAS number for sertaconazole nitrate is 99592-39-9.
Sertaconazole nitrate has 1 hydrogen bond donor count.
Sertaconazole nitrate has 6 hydrogen bond acceptor counts.
The topological polar surface area of sertaconazole nitrate is 121 Å2.