HIT ID: HIT212657826
Cas No: 948841-07-4
分子式: C15H14BrNOS
分子量: 336.25
常用名: TB5
氢键受体数 (HBA): 2
氢键供体数 (HBD): 0
LogP: 4.8459992
IUPAC: (2E)-1-(5-bromothiophen-2-yl)-3-[4-(dimethylamino)phenyl]prop-2-en-1-one
IUPAC: (2E)-1-(5-bromothiophen-2-yl)-3-[4-(dimethylamino)phenyl]prop-2-en-1-one
SMILES: CN(C)c1ccc(\C=C\C(=O)c2ccc(Br)s2)cc1
SMILES: CN(C)c1ccc(\C=C\C(=O)c2ccc(Br)s2)cc1
InChI key: PTLDLBSWTKNYCY-VMPITWQZSA-N