(R)-5-(4-Cyanobenzyl)-7-(3,5-dichlorophenyl)-5-methyl-6-oxo-6,7-dihydro-5H-imidazo[1,2-a]imidazole-3-carboxylic acid [1-acetyl-4-(1-pyridin-2-yl-cyclopropylcarbamoyl)-piperidin-4-yl]-amide
Basic information
- Standard SMILES
CC(=O)N1CCC(NC(=O)c2cnc3n2[C@](C)(Cc2ccc(C#N)cc2)C(=O)N3c2cc(Cl)cc(Cl)c2)(C(=O)NC2(c3ccccn3)CC2)CC1- InChIKey
NBCRLLSGEKTYKV-PGUFJCEWSA-N- Molecular formula
- C37H34Cl2N8O4
- Average molar mass
- 725.6 g/mol
Names & identifiers
- Preferred name
- (R)-5-(4-Cyanobenzyl)-7-(3,5-dichlorophenyl)-5-methyl-6-oxo-6,7-dihydro-5H-imidazo[1,2-a]imidazole-3-carboxylic acid [1-acetyl-4-(1-pyridin-2-yl-cyclopropylcarbamoyl)-piperidin-4-yl]-amide
- IUPAC
- (5R)-N-[1-acetyl-4-[(1-pyridin-2-ylcyclopropyl)carbamoyl]piperidin-4-yl]-5-[(4-cyanophenyl)methyl]-7-(3,5-dichlorophenyl)-5-methyl-6-oxoimidazo[1,2-a]imidazole-3-carboxamide
Names & synonyms
SCHEMBL2394357NBCRLLSGEKTYKV-PGUFJCEWSA-N(R)-5-(4-Cyanobenzyl)-7-(3,5-dichlorophenyl)-5-methyl-6-oxo-6,7-dihydro-5H-imidazo[1,2-a]imidazole-3-carboxylic acid [1-acetyl-4-(1-pyridin-2-yl-cyclopropylcarbamoyl)-piperidin-4-yl]-amide
Database identifiers
- PubChem CID
- 42632964
Properties
Computed structural properties
- XLogP
- 3.9
- Topological polar surface area
- 153 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 8
- Heavy atoms
- 51
- Formal charge
- 0
- Complexity
- 1,410
Related reactions
1 records
Compound notes
Loading…