Basic information
- Standard SMILES
CC(C)(C)[Si](C)(C)OC(Cc1ccccc1)C(=O)Nc1nnc(-c2ccc3cnccc3c2)s1- InChIKey
XGWIYIKKZOETKP-UHFFFAOYSA-N- Molecular formula
- C26H30N4O2SSi
- Average molar mass
- 490.7 g/mol
- Monoisotopic mass
- 490.18587392
Names & identifiers
- Preferred name
- (+/-)-2-(tert-butyldimethylsilyloxy)-N-(5-(isoquinolin-6-yl)-1,3,4-thiadiazol-2-yl)-3-phenylpropanamide
- IUPAC
- 2-[tert-butyl(dimethyl)silyl]oxy-N-(5-isoquinolin-6-yl-1,3,4-thiadiazol-2-yl)-3-phenylpropanamide
Names & synonyms
SCHEMBL1595981XGWIYIKKZOETKP-UHFFFAOYSA-N(+/-)-2-(tert-butyldimethylsilyloxy)-N-(5-(isoquinolin-6-yl)-1,3,4-thiadiazol-2-yl)-3-phenylpropanamide
Database identifiers
- PubChem CID
- 67089607
Properties
Computed structural properties
- Topological polar surface area
- 105 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 8
- Heavy atoms
- 34
- Formal charge
- 0
- Complexity
- 682
Related reactions
3 records
Compound notes
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