763124-72-7
2-(4-PHENYLPIPERAZINO)-N-[4-(1H-1,2,4-TRIAZOL-1-YL)PHENYL]ACETAMIDE
Name2-(4-PHENYLPIPERAZINO)-N-[4-(1H-1,2,4-TRIAZOL-1-YL)PHENYL]ACETAMIDE
1Identification
【Name】
2-(4-PHENYLPIPERAZINO)-N-[4-(1H-1,2,4-TRIAZOL-1-YL)PHENYL]ACETAMIDE
【CAS】
【MDL】
MFCD05155050
【English Synonyms】
【Formula】
C20 H22 N6 O
【MolWeight】
362.435
【Inchi】
InChI=1S/C20H22N6O/c27-20(23-17-6-8-19(9-7-17)26-16-21-15-22-26)14-24-10-12-25(13-11-24)18-4-2-1-3-5-18/h1-9,15-16H,10-14H2,(H,23,27)
【InChIKey】
InChIKey=ZUAVKSQYPBOFKR-UHFFFAOYSA-N
【SMILES】
c1ccc(cc1)N2CCN(CC2)CC(=O)Nc3ccc(cc3)n4cncn4
【MOL File】
2-(4-PHENYLPIPERAZIN….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:7
XLogP3:1.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
2-(4-PHENYLPIPERAZINO)-N-[4-(1H-1,2,4-TRIAZOL-1-YL)PHENYL]ACETAMIDE.cml