2-(3-(4-(1H-indazol-5-ylamino)quinazolin-2-yl)phenoxy)-N-(pyridin-3-yl)acetamide
Basic information
- Standard SMILES
O=C(COc1cccc(-c2nc(Nc3ccc4[nH]ncc4c3)c3ccccc3n2)c1)Nc1cccnc1- InChIKey
TWTKNUYGDKCAQH-UHFFFAOYSA-N- Molecular formula
- C28H21N7O2
- Average molar mass
- 487.5 g/mol
Names & identifiers
- Preferred name
- 2-(3-(4-(1H-indazol-5-ylamino)quinazolin-2-yl)phenoxy)-N-(pyridin-3-yl)acetamide
- IUPAC
- 2-[3-[4-(1H-indazol-5-ylamino)quinazolin-2-yl]phenoxy]-N-pyridin-3-ylacetamide
Names & synonyms
SCHEMBL1725263CHEMBL3666716TWTKNUYGDKCAQH-UHFFFAOYSA-N2-(3-(4-(1H-indazol-5-ylamino)quinazolin-2-yl)phenoxy)-N-(pyridin-3-yl)acetamide
Database identifiers
- PubChem CID
- 11612817
- ChEMBL
CHEMBL3666716
Properties
Computed structural properties
- XLogP
- 4.5
- Topological polar surface area
- 118 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 7
- Heavy atoms
- 37
- Formal charge
- 0
- Complexity
- 756
Related reactions
4 records
Compound notes
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