Basic information
- Standard SMILES
OC1c2cc(OCc3cccc(Cl)n3)ccc2OCC1Cc1ccccc1- InChIKey
ZVMPXPJYCKVQAA-UHFFFAOYSA-N- Molecular formula
- C22H20ClNO3
- Average molar mass
- 381.8 g/mol
Names & identifiers
- Preferred name
- 3-benzyl-6-[(6-chloro-2-pyridinyl)methoxy]-3,4-dihydro-2H-chromen-4-ol
- IUPAC
- 3-benzyl-6-[(6-chloro-2-pyridinyl)methoxy]-3,4-dihydro-2H-chromen-4-ol
Names & synonyms
SCHEMBL8464309
Database identifiers
- PubChem CID
- 19600605
Properties
Computed structural properties
- XLogP
- 4.4
- Topological polar surface area
- 51.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 459
Related reactions
1 records
Compound notes
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