4-(7-Azaindol-5-yloxy)-6-hydroxy-7-methoxyquinazohne
Basic information
- Standard SMILES
COc1cc2ncnc(Oc3cnc4[nH]ccc4c3)c2cc1O- InChIKey
JRGDRGQWOWLBLU-UHFFFAOYSA-N- Molecular formula
- C16H12N4O3
- Average molar mass
- 308.29 g/mol
- Monoisotopic mass
- 308.09094026
Names & identifiers
- Preferred name
- 4-(7-Azaindol-5-yloxy)-6-hydroxy-7-methoxyquinazohne
- IUPAC
- 7-methoxy-4-(1H-pyrrolo[2,3-b]pyridin-5-yloxy)quinazolin-6-ol
Names & synonyms
SCHEMBL297409JRGDRGQWOWLBLU-UHFFFAOYSA-N4-(7-azaindol-5-yloxy)-6-hydroxy-7-methoxyquinazohne4-(7-azaindol-5-yloxy)-6-hydroxy-7-methoxyquinazoline
Database identifiers
- PubChem CID
- 58960236
Properties
Computed structural properties
- XLogP
- 2.4
- Topological polar surface area
- 93.2 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 3
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 413
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Related reactions
7 records
Compound notes
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