Piperazine, 1-(2-methyl-3-(4-nitrophenyl)-1-oxo-2-propenyl)-4-phenyl-
Basic information
- CAS
76691-30-0- Standard SMILES
C/C(=C\c1ccc([N+](=O)[O-])cc1)C(=O)N1CCN(c2ccccc2)CC1- InChIKey
ZAHPBGDNCLKCCI-FOCLMDBBSA-N- Molecular formula
- C20H21N3O3
- Average molar mass
- 351.4 g/mol
- Monoisotopic mass
- 351.15829154
Names & identifiers
- Preferred name
- Piperazine, 1-(2-methyl-3-(4-nitrophenyl)-1-oxo-2-propenyl)-4-phenyl-
- IUPAC
- (E)-2-methyl-3-(4-nitrophenyl)-1-(4-phenylpiperazin-1-yl)prop-2-en-1-one
Names & synonyms
Piperazine, 1-(2-methyl-3-(4-nitrophenyl)-1-oxo-2-propenyl)-4-phenyl-76691-30-0RefChem:1095797BRN 45657541-(2-Methyl-3-(4-nitrophenyl)-1-oxo-2-propenyl)-4-phenylpiperazine
Database identifiers
- CAS
76691-30-0- PubChem CID
- 6447504
Properties
Computed structural properties
- XLogP
- 3.6
- Topological polar surface area
- 69.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 521
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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