Basic information
- Standard SMILES
Cc1ccc(-n2nc(C(C)(C)C)cc2NC(=O)Nc2ccc(-n3ccc4cnccc43)c3ccccc23)cc1- InChIKey
CJAIQZQEFKSSPK-UHFFFAOYSA-N- Molecular formula
- C32H30N6O
- Average molar mass
- 514.6 g/mol
Names & identifiers
- Preferred name
- 1-(5-tert-butyl-2-p-tolyl-2H-pyrazol-3-yl)-3-(4-pyrrolo[3,2-c]pyridin-1-yl-naphthalen-1-yl)-urea
- IUPAC
- 1-[3-tert-butyl-1-(4-methylphenyl)pyrazol-5-yl]-3-(4-pyrrolo[3,2-c]pyridin-1-ylnaphthalen-1-yl)urea
Names & synonyms
SCHEMBL6883000CJAIQZQEFKSSPK-UHFFFAOYSA-N1-(5-tert-butyl-2-p-tolyl-2H-pyrazol-3-yl)-3-(4-pyrrolo[3,2-c]pyridin-1-yl-naphthalen-1-yl)-urea
Database identifiers
- PubChem CID
- 10164692
Properties
Computed structural properties
- XLogP
- 6.8
- Topological polar surface area
- 76.8 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 39
- Formal charge
- 0
- Complexity
- 837
Related reactions
2 records
Compound notes
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