Basic information
- Standard SMILES
CC(C)(C)OC(=O)C1(NC(=O)c2cnc3n2C(C)(Cc2ccc(C#N)cc2)C(=O)N3c2cc(Cl)cc(Cl)c2)CC1- InChIKey
MWLGKMUSCXVFCI-UHFFFAOYSA-N- Molecular formula
- C29H27Cl2N5O4
- Average molar mass
- 580.5 g/mol
Names & identifiers
- Preferred name
- Tert-butyl 1-[[5-[(4-cyanophenyl)methyl]-7-(3,5-dichlorophenyl)-5-methyl-6-oxoimidazo[1,2-a]imidazole-3-carbonyl]amino]cyclopropane-1-carboxylate
- IUPAC
- tert-butyl 1-[[5-[(4-cyanophenyl)methyl]-7-(3,5-dichlorophenyl)-5-methyl-6-oxoimidazo[1,2-a]imidazole-3-carbonyl]amino]cyclopropane-1-carboxylate
Names & synonyms
SCHEMBL2392450
Database identifiers
- PubChem CID
- 67390305
Properties
Computed structural properties
- XLogP
- 5.2
- Topological polar surface area
- 117 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 8
- Heavy atoms
- 40
- Formal charge
- 0
- Complexity
- 1,070
Related reactions
1 records
Compound notes
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