769149-47-5
3-BR-N-(2-(2-(2-METHYL-3-PHENYL-2-PROPENYLIDENE)HYDRAZINO)-2-OXOETHYL)BENZAMIDE
Name3-BR-N-(2-(2-(2-METHYL-3-PHENYL-2-PROPENYLIDENE)HYDRAZINO)-2-OXOETHYL)BENZAMIDE
1Identification
【Name】
3-BR-N-(2-(2-(2-METHYL-3-PHENYL-2-PROPENYLIDENE)HYDRAZINO)-2-OXOETHYL)BENZAMIDE
【CAS】
【MDL】
MFCD05154068
【English Synonyms】
【Formula】
C19 H18 Br N3 O2
【MolWeight】
400.274
【Inchi】
InChI=1S/C19H18BrN3O2/c1-14(10-15-6-3-2-4-7-15)12-22-23-18(24)13-21-19(25)16-8-5-9-17(20)11-16/h2-12H,13H2,1H3,(H,21,25)(H,23,24)/b14-10-,22-12+
【InChIKey】
InChIKey=BYYZRWJWDBMRLQ-CIQAXZLMSA-N
【SMILES】
C/C(=C/c1ccccc1)/C=N/NC(=O)CNC(=O)c2cccc(c2)Br
【MOL File】
3-BR-N-(2-(2-(2-METH….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:2
H bond acceptor:5
XLogP3:3.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
3-BR-N-(2-(2-(2-METHYL-3-PHENYL-2-PROPENYLIDENE)HYDRAZINO)-2-OXOETHYL)BENZAMIDE.cml