Basic information
- Standard SMILES
COc1cc(OC)c2c(O)cc(-c3nc(C(C)C)cs3)nc2c1- InChIKey
CBFMPPSRBAFEAH-UHFFFAOYSA-N- Molecular formula
- C17H18N2O3S
- Average molar mass
- 330.4 g/mol
- Monoisotopic mass
- 330.10381361
Names & identifiers
- Preferred name
- 2-(4-Isopropylthiazol-2-yl)-5,7-dimethoxyquinolin-4-ol
- IUPAC
- 5,7-dimethoxy-2-(4-propan-2-yl-1,3-thiazol-2-yl)-1H-quinolin-4-one
Names & synonyms
2-(4-isopropylthiazol-2-yl)-5,7-dimethoxyquinolin-4-ol1108659-15-9SCHEMBL314374CBFMPPSRBAFEAH-UHFFFAOYSA-NDB-364087
Database identifiers
- PubChem CID
- 66650837
Properties
Computed structural properties
- XLogP
- 3.4
- Topological polar surface area
- 88.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 4
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 482
Related reactions
6 records
Compound notes
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