Basic information
- CAS
5330-87-0- Standard SMILES
O=C(NC(CSSCC(NC(=O)c1ccc([N+](=O)[O-])cc1)C(=O)O)C(=O)O)c1ccc([N+](=O)[O-])cc1- InChIKey
UVYFOLWELOVJQB-UHFFFAOYSA-N- Molecular formula
- C20H18N4O10S2
- Average molar mass
- 538.5 g/mol
- Monoisotopic mass
- 538.04643513
Names & identifiers
- Preferred name
- N,N'-Bis(4-nitrobenzoyl)cystine
- IUPAC
- 3-[[2-carboxy-2-[(4-nitrobenzoyl)amino]ethyl]disulfanyl]-2-[(4-nitrobenzoyl)amino]propanoic acid
Names & synonyms
N,N'-BIS(4-NITROBENZOYL)CYSTINE5330-87-0NSC2532DTXSID50967891NSC-2532STK671610AKOS005592487N,N'-bis[(4-nitrophenyl)carbonyl]cystine
Database identifiers
- CAS
5330-87-0- PubChem CID
- 220178
- DTXSID
DTXSID50967891
Properties
Computed structural properties
- XLogP
- 1.8
- Topological polar surface area
- 275 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 12
- Rotatable bonds
- 11
- Heavy atoms
- 36
- Formal charge
- 0
- Complexity
- 765
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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