Basic information
- Standard SMILES
Cc1nc2ccc3c(c2o1)OC(CN1CCC(C(=O)c2ccc(F)cc2)CC1)CO3- InChIKey
GKJAXFJSCIYERG-UHFFFAOYSA-N- Molecular formula
- C23H23FN2O4
- Average molar mass
- 410.4 g/mol
Names & identifiers
- Preferred name
- (4-Fluorophenyl)(1-[2-methyl-7,8-dihydro-1,6,9-trioxa-3-aza-cyclopenta[a]naphthalen-8-ylmethyl]-4-piperidinyl)methanone
- IUPAC
- (4-fluorophenyl)-[1-[(2-methyl-7,8-dihydro-[1,4]dioxino[2,3-g][1,3]benzoxazol-8-yl)methyl]piperidin-4-yl]methanone
Names & synonyms
SCHEMBL6782174GKJAXFJSCIYERG-UHFFFAOYSA-NL021884(4-Fluorophenyl) (1-[2-methyl-7,8-dihydro-1,6,9-trioxa-3-aza-cyclopenta[a]naphthalen-8-ylmethyl]-4-piperidinyl)methanone(4-Fluorophenyl)(1-[2-methyl-7,8-dihydro-1,6,9-trioxa-3-aza-cyclopenta[a]naphthalen-8-ylmethyl]-4-piperidinyl)methanone
Database identifiers
- PubChem CID
- 10158477
Properties
Computed structural properties
- XLogP
- 3.9
- Topological polar surface area
- 64.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 4
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 606
Related reactions
2 records
Compound notes
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