Basic information
- Standard SMILES
Cc1cc(C(=O)N2CCC3(CC2)CN(CC(F)(F)F)CC(CCO)O3)ccc1OC(C)C- InChIKey
YNSKCEOCTRVSMM-UHFFFAOYSA-N- Molecular formula
- C23H33F3N2O4
- Average molar mass
- 458.5 g/mol
Names & identifiers
- Preferred name
- [10-(2-Hydroxyethyl)-8-(2,2,2-trifluoroethyl)-11-oxa-3,8-diazaspiro[5.5]undecan-3-yl]-(4-isopropoxy-3-methyl-phenyl)methanone
- IUPAC
- [2-(2-hydroxyethyl)-4-(2,2,2-trifluoroethyl)-1-oxa-4,9-diazaspiro[5.5]undecan-9-yl]-(3-methyl-4-propan-2-yloxyphenyl)methanone
Names & synonyms
[10-(2-hydroxyethyl)-8-(2,2,2-trifluoroethyl)-11-oxa-3,8-diazaspiro[5.5]undecan-3-yl]-(4-isopropoxy-3-methyl-phenyl)methanoneSCHEMBL12525188
Database identifiers
- PubChem CID
- 68309480
Properties
Computed structural properties
- XLogP
- 3.4
- Topological polar surface area
- 62.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 6
- Heavy atoms
- 32
- Formal charge
- 0
- Complexity
- 623
Related reactions
2 records
Compound notes
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