1-methyl-1H-imidazole-4-carboxylic acid {2-dimethylcarbamoyl-4-[3-(2-methoxy-phenyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-phenyl}-amide
Basic information
- Standard SMILES
COc1ccccc1-c1c[nH]c2ncc(-c3ccc(NC(=O)c4cn(C)cn4)c(C(=O)N(C)C)c3)cc12- InChIKey
WTUVDVJHQITCJX-UHFFFAOYSA-N- Molecular formula
- C28H26N6O3
- Average molar mass
- 494.5 g/mol
Names & identifiers
- Preferred name
- 1-methyl-1H-imidazole-4-carboxylic acid {2-dimethylcarbamoyl-4-[3-(2-methoxy-phenyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-phenyl}-amide
- IUPAC
- N-[2-(dimethylcarbamoyl)-4-[3-(2-methoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]phenyl]-1-methylimidazole-4-carboxamide
Names & synonyms
SCHEMBL13342627WTUVDVJHQITCJX-UHFFFAOYSA-N1-methyl-1H-imidazole-4-carboxylic acid {2-dimethylcarbamoyl-4-[3-(2-methoxy-phenyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-phenyl}-amide
Database identifiers
- PubChem CID
- 57731484
Properties
Computed structural properties
- XLogP
- 3.8
- Topological polar surface area
- 105 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 6
- Heavy atoms
- 37
- Formal charge
- 0
- Complexity
- 811
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Related reactions
2 records
Compound notes
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