Structure Info
- Chemspace ID
- CSMB00025789568 (Enamine MADE)
- CAS
- 2137446-98-9
- MFCD
- MFCD30735358
- IUPAC Name
- 1-tert-butyl 2-chloromethyl 6-(propan-2-yl)-2,3-dihydro-1H-indole-1,2-dicarboxylate
- Mol formula
- C18H24ClNO4
- Mol weight
- 354 Da
- Catalog Number(s)
- BBV-118326723, CSC025789568, EN300-387323
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 4.48
- Heavy atoms count
- 24
- Rotatable bond count
- 6
- Number of rings
- 2
- Carbon bond saturation, Fsp3
- 0.555
- Polar surface area (Å)
- 56
- Hydrogen bond acceptors count
- 3
- Hydrogen bond donors count
- 0
- Zoom the structure
- CSMB00025789568
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