Piperazine, 1-(3-(p-chlorophenyl)-3-phenylpropyl)-4-(2-pyrimidyl)-, maleate
Basic information
- CAS
63978-32-5- Standard SMILES
Clc1ccc(C(CCN2CCN(c3ncccn3)CC2)c2ccccc2)cc1.O=C(O)/C=C\C(=O)O- InChIKey
PTEMHPFPHAHDEL-BTJKTKAUSA-N- Molecular formula
- C27H29ClN4O4
- Average molar mass
- 509 g/mol
- Monoisotopic mass
- 508.1877331
Names & identifiers
- Preferred name
- Piperazine, 1-(3-(p-chlorophenyl)-3-phenylpropyl)-4-(2-pyrimidyl)-, maleate
- IUPAC
- (Z)-but-2-enedioic acid;2-[4-[3-(4-chlorophenyl)-3-phenylpropyl]piperazin-1-yl]pyrimidine
Names & synonyms
Piperazine, 1-(3-(p-chlorophenyl)-3-phenylpropyl)-4-(2-pyrimidyl)-, maleate63978-32-5RefChem:10958381-(3-(p-Chlorophenyl)-3-phenylpropyl)-4-(2-pyrimidyl)piperazine maleate
Database identifiers
- CAS
63978-32-5- PubChem CID
- 6437883
Properties
Computed structural properties
- Topological polar surface area
- 107 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 8
- Heavy atoms
- 36
- Formal charge
- 0
- Complexity
- 553
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…