Basic information
- Standard SMILES
COC1CCC(CN)N(C(=O)c2nc(C)sc2-c2cccc(F)c2)C1- InChIKey
DIPVUIGIGWOQGI-UHFFFAOYSA-N- Molecular formula
- C18H22FN3O2S
- Average molar mass
- 363.5 g/mol
Names & identifiers
- Preferred name
- (2-(Aminomethyl)-5-methoxypiperidin-1-yl)(5-(3-fluorophenyl)-2-methylthiazol-4-yl)methanone
- IUPAC
- [2-(aminomethyl)-5-methoxypiperidin-1-yl]-[5-(3-fluorophenyl)-2-methyl-1,3-thiazol-4-yl]methanone
Names & synonyms
SCHEMBL15173728DIPVUIGIGWOQGI-UHFFFAOYSA-N(2-(aminomethyl)-5-methoxypiperidin-1-yl)(5-(3-fluorophenyl)-2-methylthiazol-4-yl)methanone
Database identifiers
- PubChem CID
- 89739331
Properties
Computed structural properties
- XLogP
- 2.4
- Topological polar surface area
- 96.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 4
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 470
Related reactions
1 records
Compound notes
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