Basic information
- CAS
19694-14-5- Standard SMILES
CC(C)(Cc1ccccc1)N1C(=O)N1C(C)(C)Cc1ccccc1- InChIKey
ZKQWBEDDJGVEDB-UHFFFAOYSA-N- Molecular formula
- C21H26N2O
- Average molar mass
- 322.4 g/mol
- Monoisotopic mass
- 322.20451346
Names & identifiers
- Preferred name
- Diaziridinone, bis(1,1-dimethyl-2-phenylethyl)-
- IUPAC
- 1,2-bis(2-methyl-1-phenylpropan-2-yl)diaziridin-3-one
- English name
- Bis(1,1-dimethyl-2-phenylethyl)diaziridin-3-one
- Molecular formula
- C21H26N2O
- Molecular weight
- 322.44
Names & synonyms
NSC6916081,2-bis(2-methyl-1-phenylpropan-2-yl)diaziridin-3-one19694-14-5Diaziridinone, bis(1,1-dimethyl-2-phenylethyl)-Bis(1,1-dimethyl-2-phenylethyl)diaziridin-3-oneCHEMBL1989148Diaziridinone, bis(.alpha.,.alpha.-dimethylphenethyl)-DTXSID20327827ZKQWBEDDJGVEDB-UHFFFAOYSA-NNSC-691608NCI60_0329011,2-Bis(1,1-dimethyl-2-phenylethyl)-3-diaziridinone
Show more names
3-Diaziridinone, 1,2-bis(1,1-dimethyl-2-phenylethyl)-
1,2-bis(1,1-dimethyl-2-phenyl-ethyl)diaziridin-3-one1,2-Bis(1,1-dimethyl-2-phenylethyl)-3-diaziridinone #
Database identifiers
- CAS
19694-14-5- PubChem CID
- 391928
- DTXSID
DTXSID20327827- ChEMBL
CHEMBL1989148- Nikkaji
- J111.567G
Properties
Computed structural properties
- XLogP
- 4.8
- Topological polar surface area
- 23.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 6
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 405
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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