Etibendazole
Basic information
- CAS
64420-40-2- Standard SMILES
COC(=O)Nc1nc2ccc(C3(c4ccc(F)cc4)OCCO3)cc2[nH]1- InChIKey
PEVOWKBJMJVUSV-UHFFFAOYSA-N- Molecular formula
- C18H16FN3O4
- Average molar mass
- 357.3 g/mol
- Monoisotopic mass
- 357.11248416
Overview
Etibendazole is a small molecule drug. Etibendazole has a monoisotopic molecular weight of 357.11 Da.
Names & identifiers
- Preferred name
- Etibendazole
- IUPAC
- methyl N-[6-[2-(4-fluorophenyl)-1,3-dioxolan-2-yl]-1H-benzimidazol-2-yl]carbamate
- English name
- Etibendazole
- Molecular formula
- C18H16FN3O4
- Molecular weight
- 357.34
Names & synonyms
Etibendazole64420-40-2EtibendazolNSC-3134321XU086MM3HR-34,803methyl N-[6-[2-(4-fluorophenyl)-1,3-dioxolan-2-yl]-1H-benzimidazol-2-yl]carbamateMethyl 5-(2-(p-fluorophenyl)-1,3-dioxolan-2-yl)-2-benzimidazolecarbamateCarbamic acid, (5-(2-(4-fluorophenyl)-1,3-dioxolan-2-yl)-1H-benzimidazol-2-yl)-, methyl esterR-34803EtibendazolumMethyl(5-(2-(4-fluorophenyl)-1,3-dioxolan-2-yl)-1H-benzimidazole-2-yl)carbamate
Show more names
R34803[5-[2-(4-Fluorophenyl)-1,3-dioxolan-2-yl]-1H-benzimidazol-2-yl]carbamic acid methyl esterCarbamic acid, N-[6-[2-(4-fluorophenyl)-1,3-dioxolan-2-yl]-1H-benzimidazol-2-yl]-, methyl ester
Etibendazol [Spanish]Etibendazolum [Latin]Etibendazole [USAN:INN]UNII-1XU086MM3HEtibendazole (USAN/INN)ETIBENDAZOLE [INN]ETIBENDAZOLE [USAN]SCHEMBL635506
Database identifiers
- CAS
64420-40-2
Properties
Computed structural properties
- XLogP
- 2.5
- Topological polar surface area
- 85.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 4
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 509
Physicochemical properties
- FDA UNII
- 1 XU086MM3H · 1XU086MM3H
Chemistry & industry
Applications
UsesAnthelmintic.
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Related reactions
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Compound notes
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