N,N'-[Decane-1,10-diylbis(sulfanediyl-1,3,4-thiadiazole-5,2-diyl)]dipropanamide
Basic information
- CAS
87202-67-3- Standard SMILES
CCC(=O)Nc1nnc(SCCCCCCCCCCSc2nnc(NC(=O)CC)s2)s1- InChIKey
KGWMGIZPVHUVDZ-UHFFFAOYSA-N- Molecular formula
- C20H32N6O2S4
- Average molar mass
- 516.8 g/mol
- Monoisotopic mass
- 516.14695898
Names & identifiers
- Preferred name
- N,N'-[Decane-1,10-diylbis(sulfanediyl-1,3,4-thiadiazole-5,2-diyl)]dipropanamide
- IUPAC
- N-[5-[10-[[5-(propanoylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]decylsulfanyl]-1,3,4-thiadiazol-2-yl]propanamide
Names & synonyms
87202-67-3NSC360367DTXSID40320496NSC-360367N,N'-[Decane-1,10-diylbis(sulfanediyl-1,3,4-thiadiazole-5,2-diyl)]dipropanamide
Database identifiers
- CAS
87202-67-3- PubChem CID
- 338362
- DTXSID
DTXSID40320496
Properties
Computed structural properties
- XLogP
- 5.8
- Topological polar surface area
- 217 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 10
- Rotatable bonds
- 17
- Heavy atoms
- 32
- Formal charge
- 0
- Complexity
- 502
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Related reactions
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Compound notes
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