CAS 163837-56-7 1-((4-Chlorophenyl)phenylmethyl)-4-((4-methylphenyl)sulfonyl)piperazine (HCID 10863113)

基本情報

CAS: 163837-56-7
標準SMILES: Cc1ccc(S(=O)(=O)N2CCN(C(c3ccccc3)c3ccc(Cl)cc3)CC2)cc1
InChIKey: JUQGYTLIFLVABO-UHFFFAOYSA-N
分子式: C24H25ClN2O2S
平均分子量: 441 g/mol
単同位体質量: 440.1325269

名称と識別子

優先名称: 1-((4-Chlorophenyl)phenylmethyl)-4-((4-methylphenyl)sulfonyl)piperazine
IUPAC: 1-[(4-chlorophenyl)-phenylmethyl]-4-(4-methylphenyl)sulfonylpiperazine
英語名: 1-[(4-CHLOROPHENYL)(PHENYL)METHYL]-4-[(4-METHYLPHENYL)SULFONYL]PIPERAZINE
分子式: C24H25ClN2O2S
分子量: 440.99

名称と別名

474654-20-1DTXSID5011512091-((4-Chlorophenyl)phenylmethyl)-4-((4-methylphenyl)sulfonyl)piperazine1-[(4-chlorophenyl)phenylmethyl]-4-[(4-methylphenyl)sulfonyl]piperazineRefChem:1053649DTXCID801000887163837-56-71-[(4-CHLOROPHENYL)(PHENYL)METHYL]-4-[(4-METHYLPHENYL)SULFONYL]PIPERAZINE1-[(4-chlorophenyl)-phenylmethyl]-4-(4-methylphenyl)sulfonylpiperazinePiperazine,1-[(R)-(4-chlorophenyl)phenylmethyl]-4-[(4-methylphenyl)sulfonyl]-1-[(4-Chlorophenyl)(phenyl)methyl]-4-(4-methylbenzene-1-sulfonyl)piperazineJUQGYTLIFLVABO-UHFFFAOYSA-N

名称をさらに表示

(-)-Chlorobenzohydrol(4-p- toluene sulfonyl)piperazine(R)-1-((4-Chlorophenyl)(phenyl)Methyl)-4-tosylpiperazine(-)-1-[1-(4-CHLOROPHENYL)PHENYLMETHYL]-4-[(4-METHYLPHENYL)SULFONYL]PIPERAZINE

C24H25ClN2O2SSCHEMBL587788DTXSID80446265MFCD03844692AKOS0159092771-((4-chlorophenyl)(phenyl)methyl)-4-tosylpiperazine1-[(4-chlorophenyl)-phenyl-methyl]-4-(p-tolylsulfonyl)piperazine(-)-1-[(4-chlorophenyl)phenylmethyl]-4-[(4-methylphenyl)sulfonyl]piperazine

物性

構造計算による物性

XLogP: 5.1
極性表面積: 49 Å²
水素結合供与体数: 0
水素結合受容体数: 4
回転可能結合数: 5
重原子数: 30
形式電荷: 0
複雑度: 622

化学と産業

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化合物ノート

読み込み中…

1-((4-Chlorophenyl)phenylmethyl)-4-((4-methylphenyl)sulfonyl)piperazine