Basic information
- CAS
3606-02-8- Standard SMILES
Cc1ccc(N2CCN(CCS(=O)(=O)CCN3CCN(c4ccc(C)c(Cl)c4)CC3)CC2)cc1Cl- InChIKey
IDCKOEPWWZMSTH-UHFFFAOYSA-N- Molecular formula
- C26H36Cl2N4O2S
- Average molar mass
- 539.6 g/mol
- Monoisotopic mass
- 538.193603
Names & identifiers
- Preferred name
- 1-(3-Chloro-4-methylphenyl)-4-[2-[2-[4-(3-chloro-4-methylphenyl)piperazin-1-yl]ethylsulfonyl]ethyl]piperazine
- IUPAC
- 1-(3-chloro-4-methylphenyl)-4-[2-[2-[4-(3-chloro-4-methylphenyl)piperazin-1-yl]ethylsulfonyl]ethyl]piperazine
Names & synonyms
1-(3-chloro-4-methylphenyl)-4-[2-[2-[4-(3-chloro-4-methylphenyl)piperazin-1-yl]ethylsulfonyl]ethyl]piperazine3606-02-8DLX6U9WPF4DTXSID90274632Bis[beta-[4-(3-chloro-4-methyl-phenyl)piperazino]ethyl]sulfonePiperazine, 1,1'-(sulfonyldiethylene)bis[4-(3-chloro-p-tolyl)-1,1'-[Sulfonyldi(ethane-2,1-diyl)]bis[4-(3-chloro-4-methylphenyl)piperazine]Piperazine, 1,1'-(sulfonyldi-2,1-ethanediyl)bis[4-(3-chloro-4-methylphenyl)-
Database identifiers
- CAS
3606-02-8- PubChem CID
- 19214
- DTXSID
DTXSID90274632- UNII
- DLX6U9WPF4
Properties
Computed structural properties
- XLogP
- 4.8
- Topological polar surface area
- 55.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 8
- Heavy atoms
- 35
- Formal charge
- 0
- Complexity
- 695
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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