4651-72-3
(2-AMINO-4,5,6,7-TETRAHYDRO-BENZO[B]THIOPHEN-3-YL)-PHENYL-METHANONE
Name(2-AMINO-4,5,6,7-TETRAHYDRO-BENZO[B]THIOPHEN-3-YL)-PHENYL-METHANONE
1Identification
【Name】
(2-AMINO-4,5,6,7-TETRAHYDRO-BENZO[B]THIOPHEN-3-YL)-PHENYL-METHANONE
【CAS】
【MDL】
MFCD00450864
【English Synonyms】
【Formula】
C15 H15 N O S
【MolWeight】
257.355
【Inchi】
InChI=1S/C15H15NOS/c16-15-13(11-8-4-5-9-12(11)18-15)14(17)10-6-2-1-3-7-10/h1-3,6-7H,4-5,8-9,16H2
【InChIKey】
InChIKey=QJCQJXOEXKINTC-UHFFFAOYSA-N
【SMILES】
c1ccc(cc1)C(=O)c2c3c(sc2N)CCCC3
【MOL File】
(2-AMINO-4,5,6,7-TET….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:2
XLogP3:4.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
(2-AMINO-4,5,6,7-TETRAHYDRO-BENZO[B]THIOPHEN-3-YL)-PHENYL-METHANONE.cml