Basic information
- Standard SMILES
CNC(=O)CCc1csc(Nc2ncc(Br)cc2Oc2ccccc2)n1- InChIKey
PKYXZIJXJQJZDF-UHFFFAOYSA-N- Molecular formula
- C18H17BrN4O2S
- Average molar mass
- 433.3 g/mol
- Monoisotopic mass
- 432.02556
Names & identifiers
- Preferred name
- 3-(2-(5-bromo-3-phenoxypyridin-2-ylamino)thiazol-4-yl)-N-methylpropanamide
- IUPAC
- 3-[2-[(5-bromo-3-phenoxy-2-pyridinyl)amino]-1,3-thiazol-4-yl]-N-methylpropanamide
Names & synonyms
SCHEMBL1329273PKYXZIJXJQJZDF-UHFFFAOYSA-N3-(2-(5-bromo-3-phenoxypyridin-2-ylamino)thiazol-4-yl)-N-methylpropanamide
Database identifiers
- PubChem CID
- 57742801
Properties
Computed structural properties
- XLogP
- 3.9
- Topological polar surface area
- 104 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 7
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 453
Related reactions
3 records
Compound notes
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