Structure Info
- Chemspace ID
- CSCS00015192417 (Synthesis)
- MFCD
- MFCD28400614
- IUPAC Name
- methyl 4-({1,3,3-trimethyl-6-azabicyclo[3.2.1]octan-6-yl}sulfonyl)benzoate
- Mol formula
- C18H25NO4S
- Mol weight
- 351 Da
- Catalog Number(s)
- 129053, AGNPC-0WCMVD, CSC015192417, CSCR00313994478, DQC46633, Z133609582, s_40____79469____141153
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 3.24
- Heavy atoms count
- 24
- Rotatable bond count
- 3
- Number of rings
- 3
- Carbon bond saturation, Fsp3
- 0.611
- Polar surface area (Å)
- 64
- Hydrogen bond acceptors count
- 3
- Hydrogen bond donors count
- 0
- Zoom the structure
- CSCS00015192417
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