Structure Info
- Chemspace ID
- CSMB00025789539 (Enamine MADE)
- CAS
- 2137824-93-0
- MFCD
- MFCD30734798
- IUPAC Name
- chloromethyl 1-({1-[(tert-butoxy)carbonyl]pyrrolidin-2-yl}methyl)-1H-1,2,3-triazole-4-carboxylate
- Mol formula
- C14H21ClN4O4
- Mol weight
- 345 Da
- Catalog Number(s)
- BBV-110016462, CSC025789539, EN300-386760, FCH9173058
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 2.21
- Heavy atoms count
- 23
- Rotatable bond count
- 7
- Number of rings
- 2
- Carbon bond saturation, Fsp3
- 0.714
- Polar surface area (Å)
- 87
- Hydrogen bond acceptors count
- 4
- Hydrogen bond donors count
- 0
- Zoom the structure
- CSMB00025789539
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