550299-07-5
4-(4,6-DIMETHYL-2-(THIOPHEN-2-YL)-1H-INDOL-3-YL)BUTAN-1-AMINE
Name4-(4,6-DIMETHYL-2-(THIOPHEN-2-YL)-1H-INDOL-3-YL)BUTAN-1-AMINE
1Identification
【Name】
4-(4,6-DIMETHYL-2-(THIOPHEN-2-YL)-1H-INDOL-3-YL)BUTAN-1-AMINE
【CAS】
【MDL】
MFCD05195817
【English Synonyms】
【Formula】
C18 H22 N2 S
【MolWeight】
298.452
【Inchi】
InChI=1S/C18H22N2S/c1-12-10-13(2)17-14(6-3-4-8-19)18(20-15(17)11-12)16-7-5-9-21-16/h5,7,9-11,20H,3-4,6,8,19H2,1-2H3
【InChIKey】
InChIKey=HODBIJIEDPIALF-UHFFFAOYSA-N
【SMILES】
Cc1cc(c2c(c1)[nH]c(c2CCCCN)c3cccs3)C
【MOL File】
4-(4,6-DIMETHYL-2-(T….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:2
H bond acceptor:2
XLogP3:5.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
4-(4,6-DIMETHYL-2-(THIOPHEN-2-YL)-1H-INDOL-3-YL)BUTAN-1-AMINE.cml