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Basic information
- Standard SMILES
COCC(=O)Nc1cc(Oc2ccc(NC(=O)Nc3cc(C(C)(C)C)nn3-c3ccc(C)cc3)c3ccccc23)ccn1- InChIKey
AVUUHIYJPTWYNX-UHFFFAOYSA-N- Molecular formula
- C33H34N6O4
- Average molar mass
- 578.7 g/mol
- Monoisotopic mass
- 578.26415359
Names & identifiers
- Preferred name
- US8933228, Ref 2
- IUPAC
- N-[4-[4-[[3-tert-butyl-1-(4-methylphenyl)pyrazol-5-yl]carbamoylamino]naphthalen-1-yl]oxy-2-pyridinyl]-2-methoxyacetamide
Names & synonyms
US8933228, Ref 21229606-73-8N-(4-((4-(3-(3-(tert-Butyl)-1-(p-tolyl)-1H-pyrazol-5-yl)ureido)naphthalen-1-yl)oxy)pyridin-2-yl)-2-methoxyacetamideSCHEMBL2531614CHEMBL3695569AVUUHIYJPTWYNX-UHFFFAOYSA-NBDBM142598N-(4-(4-(3-(3-tert-Butyl-1-p-tolyl-1H-pyrazol-5-yl)ureido)naphthalen-1-yloxy)pyridin-2-yl)-2-methoxyacetamide
Database identifiers
- PubChem CID
- 46218331
- ChEMBL
CHEMBL3695569
Properties
Computed structural propertiesFilling in
- XLogP
- 6
- Topological polar surface area
- 119 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 9
- Heavy atoms
- 43
- Formal charge
- 0
- Complexity
- 922
Related reactions
4 records
Compound notes
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