1-[(Furan-2-yl)methyl]-4-(4-methoxybenzene-1-sulfonyl)piperazine
Basic information
- CAS
423740-57-2- Standard SMILES
COc1ccc(S(=O)(=O)N2CCN(Cc3ccco3)CC2)cc1- InChIKey
BOWQYJCKCDMKMD-UHFFFAOYSA-N- Molecular formula
- C16H20N2O4S
- Average molar mass
- 336.4 g/mol
- Monoisotopic mass
- 336.1143783
Names & identifiers
- Preferred name
- 1-[(Furan-2-yl)methyl]-4-(4-methoxybenzene-1-sulfonyl)piperazine
- IUPAC
- 1-(furan-2-ylmethyl)-4-(4-methoxyphenyl)sulfonylpiperazine
Names & synonyms
5951-35-9CBMicro_019289Oprea1_050992Oprea1_645129CHEMBL1620441DTXSID109749201-[(Furan-2-yl)methyl]-4-(4-methoxybenzene-1-sulfonyl)piperazineCCG-13415AKOS000553244423740-57-2BIM-0019237.P001ST45109628
Show more names
4-(2-furylmethyl)-1-[(4-methoxyphenyl)sulfonyl]piperazine1-(2-Furanylmethyl)-4-[(4-methoxyphenyl)sulfonyl]piperazine1-[(furan-2-yl)methyl]-4-(4-methoxybenzene-1-sulfonyl)piperazine--oxalic acid (1/1)
Database identifiers
- CAS
423740-57-2、5951-35-9- PubChem CID
- 742579
- DTXSID
DTXSID10974920- ChEMBL
CHEMBL1620441
Properties
Computed structural properties
- XLogP
- 1.4
- Topological polar surface area
- 71.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 5
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 463
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Compound notes
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