Structure Info
- Chemspace ID
- CSSS20572375734 (In-Stock Screening Compounds)
- IUPAC Name
- (4,5,6,7-tetrahydro-1,2-benzoxazol-3-yl)methyl 2-bromo-5-chloropyridine-3-carboxylate
- Mol formula
- C14H12BrClN2O3
- Mol weight
- 372 Da
- Catalog Number(s)
- Z5982468446
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 3.72
- Heavy atoms count
- 21
- Rotatable bond count
- 4
- Number of rings
- 3
- Carbon bond saturation, Fsp3
- 0.357
- Polar surface area (Å)
- 65
- Hydrogen bond acceptors count
- 3
- Hydrogen bond donors count
- 0
- Zoom the structure
- CSSS20572375734
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