Basic information
- CAS
5569-97-1- Standard SMILES
O=C(N[C@@H](CSSC[C@H](NC(=O)c1cnc2ccccc2n1)C(=O)O)C(=O)O)c1cnc2ccccc2n1- InChIKey
PEPWIWUOQKCPTL-PMACEKPBSA-N- Molecular formula
- C24H20N6O6S2
- Average molar mass
- 552.6 g/mol
- Monoisotopic mass
- 552.08857473
Names & identifiers
- Preferred name
- Cystine, N,N-bis(2-quinoxaloyl)-, L-
- IUPAC
- (2R)-3-[[(2R)-2-carboxy-2-(quinoxaline-2-carbonylamino)ethyl]disulfanyl]-2-(quinoxaline-2-carbonylamino)propanoic acid
Names & synonyms
N,N-Bis-(2-quinoxaloyl)-L-cystineNSC 95222BRN 0736566CYSTINE, N,N-BIS(2-QUINOXALOYL)-, L-RefChem:3363825569-97-1
Database identifiers
- CAS
5569-97-1- PubChem CID
- 21737
Properties
Computed structural properties
- XLogP
- 1.4
- Topological polar surface area
- 235 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 12
- Rotatable bonds
- 11
- Heavy atoms
- 38
- Formal charge
- 0
- Complexity
- 800
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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