Basic information
- Standard SMILES
CCN(C(=O)C(C)C)c1cc(C(=O)NC(C)c2cnccn2)cc(-c2ccc(C)cc2)c1- InChIKey
OQJNMDXVFKJFBT-UHFFFAOYSA-N- Molecular formula
- C26H30N4O2
- Average molar mass
- 430.5 g/mol
Names & identifiers
- Preferred name
- 5-(Ethyl-isobutyryl-amino)-4'-methyl-biphenyl-3-carboxylic acid (1-pyrazin-2-yl-ethyl)-amide
- IUPAC
- 3-[ethyl(2-methylpropanoyl)amino]-5-(4-methylphenyl)-N-(1-pyrazin-2-ylethyl)benzamide
Names & synonyms
SCHEMBL2718082CHEMBL3719087OQJNMDXVFKJFBT-UHFFFAOYSA-N5-(ethyl-isobutyryl-amino)-4'-methyl-biphenyl-3-carboxylic acid (1-pyrazin-2-yl-ethyl)-amide
Database identifiers
- PubChem CID
- 49848201
- ChEMBL
CHEMBL3719087
Properties
Computed structural properties
- XLogP
- 3.7
- Topological polar surface area
- 75.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 7
- Heavy atoms
- 32
- Formal charge
- 0
- Complexity
- 617
Related reactions
3 records
Compound notes
Loading…