(2R)-1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-[3-(1-methyl-1H-thieno[3,2-c]pyrazol-3-yl)-phenoxy]-propan-2-ol
Completing data — refresh the page later to see the latest
Basic information
- Standard SMILES
Cn1nc(-c2cccc(OC[C@H](O)CN3CCc4ccccc4C3)c2)c2sccc21- InChIKey
DZQUSVBBJHACES-HXUWFJFHSA-N- Molecular formula
- C24H25N3O2S
- Average molar mass
- 419.5 g/mol
Names & identifiers
- Preferred name
- (2R)-1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-[3-(1-methyl-1H-thieno[3,2-c]pyrazol-3-yl)-phenoxy]-propan-2-ol
- IUPAC
- (2R)-1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-[3-(1-methylthieno[3,2-c]pyrazol-3-yl)phenoxy]propan-2-ol
Names & synonyms
SCHEMBL5459192DZQUSVBBJHACES-HXUWFJFHSA-N(2R)-1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-[3-(1-methyl-1H-thieno[3,2-c]pyrazol-3-yl)-phenoxy]-propan-2-ol
Database identifiers
- PubChem CID
- 58720296
Properties
Computed structural propertiesFilling in
- XLogP
- 3.9
- Topological polar surface area
- 78.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 6
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 567
Related reactions
1 records
Compound notes
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