Basic information
- Standard SMILES
Cc1noc(C2CN(Cc3ccccc3)CC3(CCN(C(=O)c4ccc(OC(C)C)c(C)c4)CC3)O2)n1- InChIKey
QJRSRKHZYIKGAB-UHFFFAOYSA-N- Molecular formula
- C29H36N4O4
- Average molar mass
- 504.6 g/mol
Names & identifiers
- Preferred name
- [8-Benzyl-10-(3-methyl-1,2,4-oxadiazol-5-yl)-11-oxa-3,8-diazaspiro[5.5]undecan-3-yl]-(4-isopropoxy-3-methyl-phenyl)methanone
- IUPAC
- [4-benzyl-2-(3-methyl-1,2,4-oxadiazol-5-yl)-1-oxa-4,9-diazaspiro[5.5]undecan-9-yl]-(3-methyl-4-propan-2-yloxyphenyl)methanone
Names & synonyms
SCHEMBL12494248QJRSRKHZYIKGAB-UHFFFAOYSA-N[8-benzyl-10-(3-methyl-1,2,4-oxadiazol-5-yl)-11-oxa-3,8-diazaspiro[5.5]undecan-3-yl]-(4-isopropoxy-3-methyl-phenyl)methanone
Database identifiers
- PubChem CID
- 66548173
Properties
Computed structural properties
- XLogP
- 4.2
- Topological polar surface area
- 80.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 6
- Heavy atoms
- 37
- Formal charge
- 0
- Complexity
- 752
Related reactions
4 records
Compound notes
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