Basic information
- CAS
167690-03-1- Standard SMILES
Cc1cc(C)c2c(c1)C(=O)N(C(C)(C)C)CC(=O)N2- InChIKey
HRTMCMYSZUPKMK-UHFFFAOYSA-N- Molecular formula
- C15H20N2O2
- Average molar mass
- 260.33 g/mol
- Monoisotopic mass
- 260.15247789
Names & identifiers
- Preferred name
- 1H-1,4-Benzodiazepine-2,5-dione, 4-(1,1-dimethylethyl)-3,4-dihydro-7,9-dimethyl-
- IUPAC
- 4-tert-butyl-7,9-dimethyl-1,3-dihydro-1,4-benzodiazepine-2,5-dione
Names & synonyms
1H-1,4-Benzodiazepine-2,5-dione, 4-(1,1-dimethylethyl)-3,4-dihydro-7,9-dimethyl-167690-03-1SCHEMBL9266915DTXSID001683564-tert-Butyl-7,9-dimethyl-3,4-dihydro-1H-1,4-benzodiazepine-2,5-dione
Database identifiers
- CAS
167690-03-1- PubChem CID
- 178111
- DTXSID
DTXSID00168356- Nikkaji
- J816.033C
Properties
Computed structural properties
- XLogP
- 2.1
- Topological polar surface area
- 49.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 386
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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