549480-67-3
4-(7-FLUORO-2-(4-METHYLTHIOPHEN-2-YL)-1H-INDOL-3-YL)BUTAN-1-AMINE
Name4-(7-FLUORO-2-(4-METHYLTHIOPHEN-2-YL)-1H-INDOL-3-YL)BUTAN-1-AMINE
1Identification
【Name】
4-(7-FLUORO-2-(4-METHYLTHIOPHEN-2-YL)-1H-INDOL-3-YL)BUTAN-1-AMINE
【CAS】
【MDL】
MFCD05195509
【English Synonyms】
【Formula】
C17 H19 F N2 S
【MolWeight】
302.415
【Inchi】
InChI=1S/C17H19FN2S/c1-11-9-15(21-10-11)17-13(5-2-3-8-19)12-6-4-7-14(18)16(12)20-17/h4,6-7,9-10,20H,2-3,5,8,19H2,1H3
【InChIKey】
InChIKey=ZLLUZQMYOUACHM-UHFFFAOYSA-N
【SMILES】
Cc1cc(sc1)c2c(c3cccc(c3[nH]2)F)CCCCN
【MOL File】
4-(7-FLUORO-2-(4-MET….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:2
H bond acceptor:2
XLogP3:4.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
4-(7-FLUORO-2-(4-METHYLTHIOPHEN-2-YL)-1H-INDOL-3-YL)BUTAN-1-AMINE.cml