Basic information
- Standard SMILES
CCOC(OCC)[C@H](C)N(Cc1csc2ccccc12)C(=O)[C@H](C)N- InChIKey
RWQBWKKGPLZHQN-KBPBESRZSA-N- Molecular formula
- C19H28N2O3S
- Average molar mass
- 364.5 g/mol
Names & identifiers
- Preferred name
- (S)-2-amino-N-(benzo[b]thiophen-3-ylmethyl)-N-((S)-1,1-diethoxypropan-2-yl)propanamide
- IUPAC
- (2S)-2-amino-N-(1-benzothiophen-3-ylmethyl)-N-[(2S)-1,1-diethoxypropan-2-yl]propanamide
Names & synonyms
SCHEMBL1557446RWQBWKKGPLZHQN-KBPBESRZSA-N(S)-2-amino-N-(benzo[b]thiophen-3-ylmethyl)-N-((S)-1,1-diethoxypropan-2-yl)-propanamide(S)-2-amino-N-(benzo[b]thiophen-3-ylmethyl)-N-((S)-1,1-diethoxypropan-2-yl)propanamide
Database identifiers
- PubChem CID
- 67075261
Properties
Computed structural properties
- XLogP
- 2.8
- Topological polar surface area
- 93 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 9
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 417
Related reactions
16 records
Compound notes
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