1-(2-Furoyl)-4-[(2,3,5,6-tetramethylphenyl)sulfonyl]piperazine
Basic information
- CAS
438228-10-5- Standard SMILES
Cc1cc(C)c(C)c(S(=O)(=O)N2CCN(C(=O)c3ccco3)CC2)c1C- InChIKey
MHAPMVYMVMXMGQ-UHFFFAOYSA-N- Molecular formula
- C19H24N2O4S
- Average molar mass
- 376.5 g/mol
- Monoisotopic mass
- 376.14567842
Names & identifiers
- Preferred name
- 1-(2-Furoyl)-4-[(2,3,5,6-tetramethylphenyl)sulfonyl]piperazine
- IUPAC
- furan-2-yl-[4-(2,3,5,6-tetramethylphenyl)sulfonylpiperazin-1-yl]methanone
- English name
- 1-(2-furoyl)-4-[(2,3,5,6-tetramethylphenyl)sulfonyl]piperazine
- Molecular formula
- C19H24N2O4S
- Molecular weight
- 376.46986
Names & synonyms
438228-10-51-(2-furoyl)-4-[(2,3,5,6-tetramethylphenyl)sulfonyl]piperazinefuran-2-yl-[4-(2,3,5,6-tetramethylphenyl)sulfonylpiperazin-1-yl]methanoneF3318-0591furan-2-yl(4-((2,3,5,6-tetramethylphenyl)sulfonyl)piperazin-1-yl)methanonefuran-2-yl{4-[(2,3,5,6-tetramethylphenyl)sulfonyl]piperazin-1-yl}methanoneOprea1_240839MLS001180840CHEMBL1904673DTXSID501329503HMS1591A12HMS2807B17
Show more names
SMSSF-0380155STK449186AKOS000812886SMR000476910ST50810589VU0610409-1Z295130492-furyl 4-[(2,3,5,6-tetramethylphenyl)sulfonyl]piperazinyl ketone
Database identifiers
- CAS
438228-10-5- PubChem CID
- 997353
- DTXSID
DTXSID501329503- ChEMBL
CHEMBL1904673
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 79.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 596
Experimental & physicochemical properties
Solubility4.1 [ug/mL] (The mean of the results at pH 7.4)
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Compound notes
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