549480-64-0
4-(7-FLUORO-2-(5-METHYLTHIOPHEN-2-YL)-1H-INDOL-3-YL)BUTAN-1-AMINE
Name4-(7-FLUORO-2-(5-METHYLTHIOPHEN-2-YL)-1H-INDOL-3-YL)BUTAN-1-AMINE
1Identification
【Name】
4-(7-FLUORO-2-(5-METHYLTHIOPHEN-2-YL)-1H-INDOL-3-YL)BUTAN-1-AMINE
【CAS】
【MDL】
MFCD05195506
【English Synonyms】
【Formula】
C17 H19 F N2 S
【MolWeight】
302.415
【Inchi】
InChI=1S/C17H19FN2S/c1-11-8-9-15(21-11)17-13(5-2-3-10-19)12-6-4-7-14(18)16(12)20-17/h4,6-9,20H,2-3,5,10,19H2,1H3
【InChIKey】
InChIKey=FOAJJPKUDAJAJA-UHFFFAOYSA-N
【SMILES】
Cc1ccc(s1)c2c(c3cccc(c3[nH]2)F)CCCCN
【MOL File】
4-(7-FLUORO-2-(5-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-(5-METHYLTHIOPHEN-2-YL)-1H-INDOL-3-YL)BUTAN-1-AMINE.cml