Basic information
- Standard SMILES
CC(C)(C)OC(=O)NC(C(=O)Nc1nonc1-c1noc(=O)n1-c1cccc(Cl)c1)c1ccccc1- InChIKey
XRPFWVRNZZWEMN-UHFFFAOYSA-N- Molecular formula
- C23H21ClN6O6
- Average molar mass
- 512.9 g/mol
Names & identifiers
- Preferred name
- Tert-butyl {-[({4-[4-(3-chlorophenyl)-5-oxo-4,5-dihydro-1,2,4-oxadiazol-3-yl]-1,2,5-oxadiazol-3-yl}amino)carbonyl]benzyl}carbamate
- IUPAC
- tert-butyl N-[2-[[4-[4-(3-chlorophenyl)-5-oxo-1,2,4-oxadiazol-3-yl]-1,2,5-oxadiazol-3-yl]amino]-2-oxo-1-phenylethyl]carbamate
Names & synonyms
XRPFWVRNZZWEMN-UHFFFAOYSA-Ntert-butyl {-[({4-[4-(3-chlorophenyl)-5-oxo-4,5-dihydro-1,2,4-oxadiazol-3-yl]-1,2,5-oxadiazol-3-yl}amino)carbonyl]benzyl}carbamate
Database identifiers
- PubChem CID
- 86660342
Properties
Computed structural properties
- XLogP
- 3.9
- Topological polar surface area
- 148 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 9
- Rotatable bonds
- 8
- Heavy atoms
- 36
- Formal charge
- 0
- Complexity
- 861
Related reactions
1 records
Compound notes
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