337340-62-2
2-(((2-INDOL-3-YLETHYL)AMINO)ETHYLIDENE)INDANE-1,3-DIONE
Name2-(((2-INDOL-3-YLETHYL)AMINO)ETHYLIDENE)INDANE-1,3-DIONE
1Identification
【Name】
2-(((2-INDOL-3-YLETHYL)AMINO)ETHYLIDENE)INDANE-1,3-DIONE
【CAS】
【MDL】
MFCD00171209
【English Synonyms】
【Formula】
C21 H18 N2 O2
【MolWeight】
330.385
【Inchi】
InChI=1S/C21H18N2O2/c1-13(19-20(24)16-7-2-3-8-17(16)21(19)25)22-11-10-14-12-23-18-9-5-4-6-15(14)18/h2-9,12,22-23H,10-11H2,1H3
【InChIKey】
InChIKey=MITKBTGQXPVUEF-UHFFFAOYSA-N
【SMILES】
CC(=C1C(=O)c2ccccc2C1=O)NCCc3c[nH]c4c3cccc4
【MOL File】
2-(((2-INDOL-3-YLETH….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:2
H bond acceptor:4
XLogP3:3.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
2-(((2-INDOL-3-YLETHYL)AMINO)ETHYLIDENE)INDANE-1,3-DIONE.cml