5-{[2-(6-bromo-pyridin-2-ylamino)-thiazol-5-ylmethyl]-amino}-N-cyclopropyl-2,4-difluoro-benzamide
Basic information
- Standard SMILES
O=C(NC1CC1)c1cc(NCc2cnc(Nc3cccc(Br)n3)s2)c(F)cc1F- InChIKey
FRKVCCSGIMGUIE-UHFFFAOYSA-N- Molecular formula
- C19H16BrF2N5OS
- Average molar mass
- 480.3 g/mol
Names & identifiers
- Preferred name
- 5-{[2-(6-bromo-pyridin-2-ylamino)-thiazol-5-ylmethyl]-amino}-N-cyclopropyl-2,4-difluoro-benzamide
- IUPAC
- 5-[[2-[(6-bromo-2-pyridinyl)amino]-1,3-thiazol-5-yl]methylamino]-N-cyclopropyl-2,4-difluorobenzamide
Names & synonyms
SCHEMBL2855411FRKVCCSGIMGUIE-UHFFFAOYSA-N5-{[2-(6-bromo-pyridin-2-ylamino)-thiazol-5-ylmethyl]-amino}-N-cyclopropyl-2,4-difluoro-benzamide
Database identifiers
- PubChem CID
- 22019067
Properties
Computed structural properties
- XLogP
- 4.7
- Topological polar surface area
- 107 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 7
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 575
Related reactions
3 records
Compound notes
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