Basic information
- Standard SMILES
Cc1nc(-c2cncc(I)n2)sc1C(=O)NCc1ccc(F)cc1- InChIKey
KGNFDKHCWKAFGJ-UHFFFAOYSA-N- Molecular formula
- C16H12FIN4OS
- Average molar mass
- 454.3 g/mol
Names & identifiers
- Preferred name
- 2-(6-Iodo-pyrazin-2-yl)-4-methyl-thiazole-5-carboxylic acid 4-fluoro benzylamide
- IUPAC
- N-[(4-fluorophenyl)methyl]-2-(6-iodopyrazin-2-yl)-4-methyl-1,3-thiazole-5-carboxamide
Names & synonyms
SCHEMBL3045493KGNFDKHCWKAFGJ-UHFFFAOYSA-N2-(6-iodo-pyrazin-2-yl)-4-methyl-thiazole-5-carboxylic acid 4-fluoro benzylamide2-(6-iodo-pyrazin-2-yl)-4-methyl-thiazole-5-carboxylic acid 4-fluoro-benzylamide
Database identifiers
- PubChem CID
- 86645558
Properties
Computed structural properties
- XLogP
- 2.8
- Topological polar surface area
- 96 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 4
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 438
Related reactions
22 records
Compound notes
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