Cas no 104481-81-4 (4-Thiazolecarboxylic acid,2-[4-[(3,5-dimethylphenyl)methyl]-1-piperazinyl]-, ethyl ester)

4-Thiazolecarboxylic acid,2-[4-[(3,5-dimethylphenyl)methyl]-1-piperazinyl]-, ethyl ester structure
104481-81-4 structure
Product Name:4-Thiazolecarboxylic acid,2-[4-[(3,5-dimethylphenyl)methyl]-1-piperazinyl]-, ethyl ester
CAS No:104481-81-4
MF:C19H25N3O2S
MW:359.485703229904
CID:1143346
Update Time:2024-07-26

4-Thiazolecarboxylic acid,2-[4-[(3,5-dimethylphenyl)methyl]-1-piperazinyl]-, ethyl ester Chemical and Physical Properties

Names and Identifiers

    • 4-Thiazolecarboxylic acid,2-[4-[(3,5-dimethylphenyl)methyl]-1-piperazinyl]-, ethyl ester
    • 4-Thiazolecarboxylic acid, 2-[4-[(3,5-dimethylphenyl)methyl]-1-piperazinyl]-, ethyl ester
    • Inchi: 1S/C19H25N3O2S/c1-4-24-18(23)17-13-25-19(20-17)22-7-5-21(6-8-22)12-16-10-14(2)9-15(3)11-16/h9-11,13H,4-8,12H2,1-3H3
    • InChI Key: FGFUKWPFRPNARZ-UHFFFAOYSA-N
    • SMILES: S1C=C(C(OCC)=O)N=C1N1CCN(CC2=CC(C)=CC(C)=C2)CC1

Computed Properties

  • Exact Mass: 359.16695

Experimental Properties

  • Density: 1.195±0.06 g/cm3(Predicted)
  • Boiling Point: 484.9±55.0 °C(Predicted)
  • PSA: 45.67
  • pka: 6.82±0.10(Predicted)
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