Basic information
- Standard SMILES
Cc1csc2nc(C(C)N=[N+]=[N-])c(-c3cccc(F)c3)c(=O)n12- InChIKey
CZDLWSOJVQRKRC-UHFFFAOYSA-N- Molecular formula
- C15H12FN5OS
- Average molar mass
- 329.4 g/mol
Names & identifiers
- Preferred name
- 7-(1-azidoethyl)-6-(3-fluorophenyl)-3-methyl-5H-[1,3]thiazolo[3,2-a]pyrimidin-5-one
- IUPAC
- 7-(1-azidoethyl)-6-(3-fluorophenyl)-3-methyl-[1,3]thiazolo[3,2-a]pyrimidin-5-one
Names & synonyms
SCHEMBL16417530CZDLWSOJVQRKRC-UHFFFAOYSA-N7-(1-azidoethyl)-6-(3-fluorophenyl)-3-methyl-5H-[1,3]thiazolo[3,2-a]pyrimidin-5-one
Database identifiers
- PubChem CID
- 58111402
Properties
Computed structural properties
- XLogP
- 3.6
- Topological polar surface area
- 72.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 3
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 679
Related reactions
8 records
Compound notes
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