Structure Info
- Chemspace ID
- CSCS00097746667 (Synthesis)
- IUPAC Name
- 3-fluoro-4-{[(1R,9R)-6-oxo-7,11-diazatricyclo[7.3.1.0²,⁷]trideca-2,4-dien-11-yl]sulfonyl}benzoic acid
- Mol formula
- C18H17FN2O5S
- Mol weight
- 392 Da
- Catalog Number(s)
- CSC097746667, CSCR00521308524, Z2351755740, s_271082____10687312____8788524
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 0.74
- Heavy atoms count
- 27
- Rotatable bond count
- 2
- Number of rings
- 4
- Carbon bond saturation, Fsp3
- 0.333
- Polar surface area (Å)
- 95
- Hydrogen bond acceptors count
- 5
- Hydrogen bond donors count
- 1
- Zoom the structure
- CSCS00097746667
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