Propanamide, N-(4-ethylphenyl)-2-[[5-[(4-methyl-1-piperazinyl)sulfonyl]-2-pyridinyl]thio]-
Bezeichnung:Propanamide, N-(4-ethylphenyl)-2-[[5-[(4-methyl-1-piperazinyl)sulfonyl]-2-pyridinyl]thio]-
CAS-Nr869356-20-7
Englisch Name:Propanamide, N-(4-ethylphenyl)-2-[[5-[(4-methyl-1-piperazinyl)sulfonyl]-2-pyridinyl]thio]-
CBNumberCB511613216
SummenformelC21H28N4O3S2
Molgewicht448.6
MOL-Datei869356-20-7.mol
Propanamide, N-(4-ethylphenyl)-2-[[5-[(4-methyl-1-piperazinyl)sulfonyl]-2-pyridinyl]thio]- physikalisch-chemischer Eigenschaften
Dichte | 1.32±0.1 g/cm3(Predicted) |
pka | 13.46±0.70(Predicted) |
InChI | InChI=1S/C21H28N4O3S2/c1-4-17-5-7-18(8-6-17)23-21(26)16(2)29-20-10-9-19(15-22-20)30(27,28)25-13-11-24(3)12-14-25/h5-10,15-16H,4,11-14H2,1-3H3,(H,23,26) |
InChIKey | GXWZOQWYYLHQKV-UHFFFAOYSA-N |
SMILES | C(NC1=CC=C(CC)C=C1)(=O)C(SC1=NC=C(S(N2CCN(C)CC2)(=O)=O)C=C1)C |