Basic information
- Standard SMILES
CCOC(OCC)[C@H](C)N(Cc1csc2ccccc12)C(=O)[C@H](C)NC(=O)OCC1c2ccccc2-c2ccccc21- InChIKey
LKQNEQDKBKDHFU-GOTSBHOMSA-N- Molecular formula
- C34H38N2O5S
- Average molar mass
- 586.7 g/mol
- Monoisotopic mass
- 586.25014349
Names & identifiers
- Preferred name
- (9H-Fluoren-9-yl)methyl (S)-1-((benzo[b]thiophen-3-ylmethyl)((S)-1,1-diethoxypropan-2-yl)amino)-1-oxopropan-2-ylcarbamate
- IUPAC
- 9H-fluoren-9-ylmethyl N-[(2S)-1-[1-benzothiophen-3-ylmethyl-[(2S)-1,1-diethoxypropan-2-yl]amino]-1-oxopropan-2-yl]carbamate
Names & synonyms
LKQNEQDKBKDHFU-GOTSBHOMSA-N(9H-Fluoren-9-yl)methyl (S)-1-((benzo[b]thiophen-3-ylmethyl)((S)-1,1-diethoxypropan-2-yl)amino)-1-oxopropan-2-ylcarbamate(9H-Fluoren-9-yl)methyl(S)-1-((benzo[b]thiophen-3-ylmethyl)((S)-1,1-diethoxypropan-2-yl)amino)-1-oxopropan-2-ylcarbamate
Database identifiers
- PubChem CID
- 86652579
Properties
Computed structural properties
- XLogP
- 6.5
- Topological polar surface area
- 105 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 13
- Heavy atoms
- 42
- Formal charge
- 0
- Complexity
- 862
Related reactions
3 records
Compound notes
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