Urea, 1,1'-(1,4-piperazinediylbis(trimethylene))bis(3-(p-bromophenyl)-
Basic information
- CAS
55291-05-9- Standard SMILES
O=C(NCCCN1CCN(CCCNC(=O)Nc2ccc(Br)cc2)CC1)Nc1ccc(Br)cc1- InChIKey
NPEOEWIHBHMVES-UHFFFAOYSA-N- Molecular formula
- C24H32Br2N6O2
- Average molar mass
- 596.4 g/mol
- Monoisotopic mass
- 594.09535
Names & identifiers
- Preferred name
- Urea, 1,1'-(1,4-piperazinediylbis(trimethylene))bis(3-(p-bromophenyl)-
- IUPAC
- 1-(4-bromophenyl)-3-[3-[4-[3-[(4-bromophenyl)carbamoylamino]propyl]piperazin-1-yl]propyl]urea
- English name
- 1,4-Bis[3-[3-(4-bromophenyl)ureido]propyl]piperazine
- Molecular formula
- C24H32Br2N6O2
- Molecular weight
- 596.36
Names & synonyms
55291-05-9Urea, 1,1'-(1,4-piperazinediylbis(trimethylene))bis(3-(p-bromophenyl)-NSC 94505BRN 0867041N,N'-Bis(3-(3-(p-bromophenyl)ureylene)propyl)piperazineNSC94505Piperazine, 1,4-bis(3-(3-(p-bromophenyl)ureido)propyl)-Piperazine, N,N'-bis(3-(3-(p-bromophenyl)ureylene)propyl)-DTXSID10203803NSC-94505Urea, N,N''-(1,4-piperazinediyldi-3,1-propanediyl)bis(N'-(4-bromophenyl)-Piperazine,4-bis[3-[3-(p-bromophenyl)ureido]propyl]-
Show more names
1,4-Bis[3-[3-(4-bromophenyl)ureido]propyl]piperazine1,1'-[(1,4-Piperazinediyl)bis(trimethylene)]bis[3-(p-bromophenyl)urea]Urea, N,N''-(1,4-piperazinediyldi-3,1-propanediyl)bis[N'-(4-bromophenyl)- (9CI)
Urea,1'-[1,4-piperazinediylbis(trimethylene)]bis[3-(p-bromophenyl)-Urea,N''-(1,4-piperazinediyldi-3,1-propanediyl)bis[N'-(4-bromophenyl)-N,N'-[Piperazine-1,4-diyldi(propane-3,1-diyl)]bis[N'-(4-bromophenyl)urea]
Database identifiers
- CAS
55291-05-9- PubChem CID
- 96934
- DTXSID
DTXSID10203803- Nikkaji
- J93.324D
Properties
Computed structural properties
- XLogP
- 3.6
- Topological polar surface area
- 88.7 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 10
- Heavy atoms
- 34
- Formal charge
- 0
- Complexity
- 552
Physicochemical properties
- Comptox DTXSID
- 10203803 · DTXSID10203803
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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