Basic information
- Standard SMILES
Cc1ccc(CN2C(=O)NC(CCCc3ccc(OC(C)(C)C(=O)OC(C)(C)C)cc3)C2=O)cc1C- InChIKey
BCIXSJWBVYLHMP-UHFFFAOYSA-N- Molecular formula
- C29H38N2O5
- Average molar mass
- 494.6 g/mol
Names & identifiers
- Preferred name
- 2-(4-{3-[1-(3,4-Dimethyl-benzyl)-2,5-dioxo-imidazolidin-4-yl]-propyl}-phenoxy)-2-methyl-propionic acid tert-butyl ester
- IUPAC
- tert-butyl 2-[4-[3-[1-[(3,4-dimethylphenyl)methyl]-2,5-dioxoimidazolidin-4-yl]propyl]phenoxy]-2-methylpropanoate
Names & synonyms
SCHEMBL3989020BCIXSJWBVYLHMP-UHFFFAOYSA-N2-(4-{3-[1-(3,4-dimethyl-benzyl)-2,5-dioxo-imidazolidin-4-yl]-propyl}-phenoxy)-2-methyl-propionic acid tert-butyl ester
Database identifiers
- PubChem CID
- 57719087
Properties
Computed structural properties
- XLogP
- 5.5
- Topological polar surface area
- 84.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 11
- Heavy atoms
- 36
- Formal charge
- 0
- Complexity
- 781
Related reactions
4 records
Linked notes
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