256458-82-9
1-PIPERAZINECARBOXAMIDE, N-(4-BROMOPHENYL)-4-(1H-INDOL-4-YL)-, MONOHYDROCHLORIDE
Name1-PIPERAZINECARBOXAMIDE, N-(4-BROMOPHENYL)-4-(1H-INDOL-4-YL)-, MONOHYDROCHLORIDE
FormulaC19 H19 Br N4 O . Cl H
1Identification
【Name】
1-PIPERAZINECARBOXAMIDE, N-(4-BROMOPHENYL)-4-(1H-INDOL-4-YL)-, MONOHYDROCHLORIDE
【CAS】
【MDL】
MFCD00829544
【English Synonyms】
【Formula】
C19 H19 Br N4 O . Cl H
【MolWeight】
435.751
【Inchi】
InChI=1S/C19H19BrN4O.ClH/c20-14-4-6-15(7-5-14)22-19(25)24-12-10-23(11-13-24)18-3-1-2-17-16(18)8-9-21-17;/h1-9,21H,10-13H2,(H,22,25);1H
【InChIKey】
InChIKey=MEWPJJJMBCTNGH-UHFFFAOYSA-N
【SMILES】
c1cc2c(cc[nH]2)c(c1)N3CCN(CC3)C(=O)Nc4ccc(cc4)Br.Cl
【MOL File】
1-PIPERAZINECARBOXAM….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:2
H bond acceptor:5
XLogP3:4.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
1-PIPERAZINECARBOXAMIDE, N-(4-BROMOPHENYL)-4-(1H-INDOL-4-YL)-, MONOHYDROCHLORIDE.cml