3-Amino-oxetane-3-carboxylic acid ((R)-1-{5-[5-chloro-3-fluoro-2-(5-methyl-[1,2,4]oxadiazol-3-yl)-phenyl]-3-fluoro-pyridin-2-yl}-ethyl)-amide
Basic information
- Standard SMILES
Cc1nc(-c2c(F)cc(Cl)cc2-c2cnc([C@@H](C)NC(=O)C3(N)COC3)c(F)c2)no1- InChIKey
ZFQWDNVHNBCMOY-SECBINFHSA-N- Molecular formula
- C20H18ClF2N5O3
- Average molar mass
- 449.8 g/mol
Names & identifiers
- Preferred name
- 3-Amino-oxetane-3-carboxylic acid ((R)-1-{5-[5-chloro-3-fluoro-2-(5-methyl-[1,2,4]oxadiazol-3-yl)-phenyl]-3-fluoro-pyridin-2-yl}-ethyl)-amide
- IUPAC
- 3-amino-N-[(1R)-1-[5-[5-chloro-3-fluoro-2-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]-3-fluoro-2-pyridinyl]ethyl]oxetane-3-carboxamide
Names & synonyms
SCHEMBL9948171ZFQWDNVHNBCMOY-SECBINFHSA-N3-Amino-oxetane-3-carboxylic acid ((R)-1-{5-[5-chloro-3-fluoro-2-(5-methyl-[1,2,4]oxadiazol-3-yl)-phenyl]-3-fluoro-pyridin-2-yl}-ethyl)-amide
Database identifiers
- PubChem CID
- 67979461
Properties
Computed structural properties
- XLogP
- 1.7
- Topological polar surface area
- 116 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 9
- Rotatable bonds
- 5
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 660
Related reactions
1 records
Compound notes
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