Urea, N,N''-(1,4-piperazinediyldi-3,1-propanediyl)bis(N'-(2-chlorophenyl)-
Basic information
- CAS
55291-02-6- Standard SMILES
O=C(NCCCN1CCN(CCCNC(=O)Nc2ccccc2Cl)CC1)Nc1ccccc1Cl- InChIKey
YCVOCZGRLPVFNG-UHFFFAOYSA-N- Molecular formula
- C24H32Cl2N6O2
- Average molar mass
- 507.5 g/mol
- Monoisotopic mass
- 506.1963797
Names & identifiers
- Preferred name
- Urea, N,N''-(1,4-piperazinediyldi-3,1-propanediyl)bis(N'-(2-chlorophenyl)-
- IUPAC
- 1-(2-chlorophenyl)-3-[3-[4-[3-[(2-chlorophenyl)carbamoylamino]propyl]piperazin-1-yl]propyl]urea
Names & synonyms
55291-02-6Urea, N,N''-(1,4-piperazinediyldi-3,1-propanediyl)bis(N'-(2-chlorophenyl)-BRN 0868681NSC94506N,N''-(1,4-Piperazinediyldi-3,1-propanediyl)bis(N'-(2-chlorophenyl)urea)DTXSID30203800NSC 94506NSC-94506DS-011684N,n-(1,4-piperazinediyldi-3,1-propanediyl)bis(n-(2-chlorophenyl)urea)N,N'-[Piperazine-1,4-diyldi(propane-3,1-diyl)]bis[N'-(2-chlorophenyl)urea]
Database identifiers
- CAS
55291-02-6- PubChem CID
- 96935
- DTXSID
DTXSID30203800
Properties
Computed structural properties
- XLogP
- 3.4
- 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
- 568
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Compound notes
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