Basic information
- Standard SMILES
COCc1nn(C(c2ccccc2)(c2ccccc2)c2ccccc2)c2cc(Cl)ncc12- InChIKey
WXLDUDWCJYDROJ-UHFFFAOYSA-N- Molecular formula
- C27H22ClN3O
- Average molar mass
- 439.9 g/mol
- Monoisotopic mass
- 439.14514
Names & identifiers
- Preferred name
- 6-chloro-3-(methoxymethyl)-1-trityl-1H-pyrazolo[4,3-c]pyridine
- IUPAC
- 6-chloro-3-(methoxymethyl)-1-tritylpyrazolo[4,3-c]pyridine
Names & synonyms
SCHEMBL14896462WXLDUDWCJYDROJ-UHFFFAOYSA-N6-chloro-3-(methoxymethyl)-1-trityl-1H-pyrazolo[4,3-c]pyridine
Database identifiers
- PubChem CID
- 89526490
Properties
Computed structural properties
- XLogP
- 5.9
- Topological polar surface area
- 39.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 6
- Heavy atoms
- 32
- Formal charge
- 0
- Complexity
- 540
Related reactions
1 records
Compound notes
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