Basic information
- Standard SMILES
COc1cccc(Nc2c(C(N)=O)cnc3c(C)cc(S(=O)(=O)c4cccc(C(=O)Nc5ccc(CCCCOCCCCCCN(CC(O[Si](C)(C)C(C)(C)C)c6ccc(OC(=O)OC(C)(C)C)c7[nH]c(=O)ccc67)C(=O)OC(C)(C)C)cc5)c4)cc23)c1- InChIKey
YTSWDXJPLVTJEU-UHFFFAOYSA-N- Molecular formula
- C68H86N6O13SSi
- Average molar mass
- 1,255.6 g/mol
- Monoisotopic mass
- 1,254.57428453
Names & identifiers
- Preferred name
- tert-butyl [5-[1-[tert-butyl(dimethyl)silyl]oxy-2-[6-[4-[4-[[3-[3-carbamoyl-4-(3-methoxyanilino)-8-methylquinolin-6-yl]sulfonylbenzoyl]amino]phenyl]butoxy]hexyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]ethyl]-2-oxo-1H-quinolin-8-yl] carbonate
- IUPAC
- tert-butyl [5-[1-[tert-butyl(dimethyl)silyl]oxy-2-[6-[4-[4-[[3-[3-carbamoyl-4-(3-methoxyanilino)-8-methylquinolin-6-yl]sulfonylbenzoyl]amino]phenyl]butoxy]hexyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]ethyl]-2-oxo-1H-quinolin-8-yl] carbonate
Database identifiers
- PubChem CID
- 123722934
Properties
Computed structural properties
- Topological polar surface area
- 261 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 15
- Rotatable bonds
- 32
- Heavy atoms
- 89
- Formal charge
- 0
- Complexity
- 2,450
Related reactions
1 records
Compound notes
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