Basic information
- Standard SMILES
Cc1nc(Cn2c(=O)sc3cc(F)c([N+](=O)[O-])cc32)no1- InChIKey
LQJLXLMTCULOFL-UHFFFAOYSA-N- Molecular formula
- C11H7FN4O4S
- Average molar mass
- 310.26 g/mol
Names & identifiers
- Preferred name
- 6-fluoro-3-(5-methyl-1,2,4-oxadiazol-3-ylmethyl)-5-nitro-2(3H)-benzothiazolone
- IUPAC
- 6-fluoro-3-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]-5-nitro-1,3-benzothiazol-2-one
Names & synonyms
SCHEMBL9687415LQJLXLMTCULOFL-UHFFFAOYSA-N6-fluoro-3-(5-methyl-1,2,4-oxadiazol-3-yl-methyl)-5-nitro-2(3H)-benzothiazolone6-fluoro-3-(5-methyl-1,2,4-oxadiazol-3-ylmethyl)-5 -nitro-2(3H)-benzothiazolone6-fluoro-3-(5-methyl-1,2,4-oxadiazol-3-ylmethyl)-5-nitro-2(3H)-benzothiazolone
Database identifiers
- PubChem CID
- 19979488
Properties
Computed structural properties
- XLogP
- 1.9
- Topological polar surface area
- 130 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 2
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 450
Related reactions
3 records
Compound notes
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