Basic information
- Standard SMILES
CCCCCC(SCC(NC(C)=O)C(=O)O)(SCC(NC(C)=O)C(=O)O)N1C(=O)CCC1=O- InChIKey
KDJNMLZRQOKHHH-UHFFFAOYSA-N- Molecular formula
- C20H31N3O8S2
- Average molar mass
- 505.6 g/mol
Names & identifiers
- Preferred name
- Bis-(2-Acetylamino-2-Carboxyethylthio)succinimidyl Hexane
- IUPAC
- 2-acetamido-3-[1-(2-acetamido-2-carboxyethyl)sulfanyl-1-(2,5-dioxopyrrolidin-1-yl)hexyl]sulfanylpropanoic acid
Names & synonyms
SCHEMBL6848243KDJNMLZRQOKHHH-UHFFFAOYSA-NBis-(2-Acetylamino-2-Carboxyethylthio)succinimidyl Hexane
Database identifiers
- PubChem CID
- 86759503
Properties
Computed structural properties
- XLogP
- 0.7
- Topological polar surface area
- 221 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 10
- Rotatable bonds
- 15
- Heavy atoms
- 33
- Formal charge
- 0
- Complexity
- 722
Related reactions
1 records
Compound notes
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