Basic information
- Standard SMILES
O=C1OC2CCCN(Cc3ccc(Cl)nc3)C2=C1Cl- InChIKey
YKICSMAEIXVQMQ-UHFFFAOYSA-N- Molecular formula
- C13H12Cl2N2O2
- Average molar mass
- 299.15 g/mol
Names & identifiers
- Preferred name
- 3-chloro-4-[(6-chloropyridin-3-yl)methyl]-5,6,7,7a-tetrahydrofuro[3,2-b]pyridin-2(4H)-one
- IUPAC
- 3-chloro-4-[(6-chloro-3-pyridinyl)methyl]-5,6,7,7a-tetrahydrofuro[3,2-b]pyridin-2-one
Names & synonyms
SCHEMBL1804614YKICSMAEIXVQMQ-UHFFFAOYSA-N3-chloro-4-[(6-chloropyridin-3-yl)methyl]-5,6,7,7a-tetrahydrofuro[3,2-b]pyridin-2(4H)-one
Database identifiers
- PubChem CID
- 57779810
Properties
Computed structural properties
- XLogP
- 2.8
- Topological polar surface area
- 42.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 413
Related reactions
2 records
Compound notes
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