99532-46-4
1-(6-METHOXY-1-(PHENYLSULFONYL)-1H-INDOL-3-YL)ETHANONE
Name1-(6-METHOXY-1-(PHENYLSULFONYL)-1H-INDOL-3-YL)ETHANONE
1Identification
【Name】
1-(6-METHOXY-1-(PHENYLSULFONYL)-1H-INDOL-3-YL)ETHANONE
【CAS】
【MDL】
MFCD12923114
【English Synonyms】
【Formula】
C17 H15 N O4 S
【MolWeight】
329.375
【Inchi】
InChI=1S/C17H15NO4S/c1-12(19)16-11-18(17-10-13(22-2)8-9-15(16)17)23(20,21)14-6-4-3-5-7-14/h3-11H,1-2H3
【InChIKey】
InChIKey=OMSLVVFDGZDEIX-UHFFFAOYSA-N
【SMILES】
CC(=O)c1cn(c2c1ccc(c2)OC)S(=O)(=O)c3ccccc3
【MOL File】
1-(6-METHOXY-1-(PHEN….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:5
XLogP3:3.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
1-(6-METHOXY-1-(PHENYLSULFONYL)-1H-INDOL-3-YL)ETHANONE.cml