256458-66-9
1-[(4-CYANOPHENYL)SULFONYL]-4-(1H-INDOL-4-YL)-PIPERAZINE
Name1-[(4-CYANOPHENYL)SULFONYL]-4-(1H-INDOL-4-YL)-PIPERAZINE
1Identification
【Name】
1-[(4-CYANOPHENYL)SULFONYL]-4-(1H-INDOL-4-YL)-PIPERAZINE
【CAS】
【MDL】
MFCD00829528
【English Synonyms】
【Formula】
C19 H18 N4 O2 S
【MolWeight】
366.443
【Inchi】
InChI=1S/C19H18N4O2S/c20-14-15-4-6-16(7-5-15)26(24,25)23-12-10-22(11-13-23)19-3-1-2-18-17(19)8-9-21-18/h1-9,21H,10-13H2
【InChIKey】
InChIKey=HGDORJWQJKIXPO-UHFFFAOYSA-N
【SMILES】
c1cc2c(cc[nH]2)c(c1)N3CCN(CC3)S(=O)(=O)c4ccc(cc4)C#N
【MOL File】
1-[(4-CYANOPHENYL)SU….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:6
XLogP3:2.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
1-[(4-CYANOPHENYL)SULFONYL]-4-(1H-INDOL-4-YL)-PIPERAZINE.cml