Basic information
- Standard SMILES
CCOC(OCC)[C@H](C)N(Cc1cccc2cccnc12)C(=O)[C@H](CC(=O)NC(c1ccccc1)(c1ccccc1)c1ccccc1)NC(=O)OCC1c2ccccc2-c2ccccc21- InChIKey
SKDZCJRXTFFTDB-PDMWITDRSA-N- Molecular formula
- C55H54N4O6
- Average molar mass
- 867 g/mol
- Monoisotopic mass
- 866.40433546
Names & identifiers
- Preferred name
- (9H-Fluoren-9-yl)methyl(S)-1-(((S)-1,1-diethoxypropan-2-yl)(quinolin-8-ylmethyl)amino)-1,4-dioxo-4-(tritylamino)butan-2-ylcarbamate
- IUPAC
- 9H-fluoren-9-ylmethyl N-[(2S)-1-[[(2S)-1,1-diethoxypropan-2-yl]-(quinolin-8-ylmethyl)amino]-1,4-dioxo-4-(tritylamino)butan-2-yl]carbamate
Names & synonyms
SKDZCJRXTFFTDB-PDMWITDRSA-N(9H-Fluoren-9-yl)methyl (S)-1-(((S)-1,1-diethoxypropan-2-yl)(quinolin-8-ylmethyl)amino)-1,4-dioxo-4-(tritylamino)butan-2-ylcarbamate(9H-Fluoren-9-yl)methyl(S)-1-(((S)-1,1-diethoxypropan-2-yl)(quinolin-8-ylmethyl)amino)-1,4-dioxo-4-(tritylamino)butan-2-ylcarbamate
Database identifiers
- PubChem CID
- 86698535
Properties
Computed structural properties
- XLogP
- 9.3
- Topological polar surface area
- 119 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 19
- Heavy atoms
- 65
- Formal charge
- 0
- Complexity
- 1,420
Related reactions
3 records
Compound notes
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