Basic information
- Standard SMILES
COC(=O)[C@H](CC(C)C)NC(=O)c1cccc2[nH]c(-c3ccncc3)nc12- InChIKey
IQFSRFBRQIJNHL-INIZCTEOSA-N- Molecular formula
- C20H22N4O3
- Average molar mass
- 366.4 g/mol
Names & identifiers
- Preferred name
- (2-(Pyrid-4-yl)-1h-benzimidazole-4-carbonyl)-(l)-leucine methyl ester
- IUPAC
- methyl (2S)-4-methyl-2-[(2-pyridin-4-yl-1H-benzimidazole-4-carbonyl)amino]pentanoate
Names & synonyms
SCHEMBL6223206IQFSRFBRQIJNHL-INIZCTEOSA-N(2-(pyrid-4-yl)-1h-benzimidazole-4-carbonyl)-(l)-leucine methyl ester
Database identifiers
- PubChem CID
- 15480893
Properties
Computed structural properties
- XLogP
- 3
- Topological polar surface area
- 97 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 7
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 521
Related reactions
1 records
Compound notes
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