Basic information
- Standard SMILES
Cn1nc(-c2ccc(N3C[C@H](Cn4ccnn4)OC3=O)cc2)cc1C=O- InChIKey
VVTVFRUEWQQSFV-HNNXBMFYSA-N- Molecular formula
- C17H16N6O3
- Average molar mass
- 352.3 g/mol
- Monoisotopic mass
- 352.12838839
Names & identifiers
- Preferred name
- 1-Methyl-3-{4-[(5R)-2-oxo-5-(1H-1,2,3-triazol-1-ylmethyl)-1,3-oxazolidin-3-yl]phenyl}-1H-pyrazole-5-carbaldehyde
- IUPAC
- 1-methyl-3-[4-[(5R)-2-oxo-5-(triazol-1-ylmethyl)-1,3-oxazolidin-3-yl]phenyl]pyrazole-5-carbaldehyde
Names & synonyms
SCHEMBL5387539VVTVFRUEWQQSFV-HNNXBMFYSA-N1-Methyl-3-{4-[(5R)-2-oxo-5-(1H-1,2,3-triazol-1-ylmethyl)-1,3-oxazolidin-3-yl]phenyl}-1H-pyrazole-5-carbaldehyde
Database identifiers
- PubChem CID
- 10247430
Properties
Computed structural properties
- XLogP
- 0.7
- Topological polar surface area
- 95.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 5
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 527
Related reactions
1 records
Compound notes
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