769150-61-0
4-BR-2-(2-(((2-CHLOROBENZOYL)AMINO)AC)CARBOHYDRAZONOYL)PHENYL 2-CHLOROBENZOATE
Name4-BR-2-(2-(((2-CHLOROBENZOYL)AMINO)AC)CARBOHYDRAZONOYL)PHENYL 2-CHLOROBENZOATE
FormulaC23 H16 Br Cl2 N3 O4
1Identification
【Name】
4-BR-2-(2-(((2-CHLOROBENZOYL)AMINO)AC)CARBOHYDRAZONOYL)PHENYL 2-CHLOROBENZOATE
【CAS】
【MDL】
MFCD05153940
【English Synonyms】
【Formula】
C23 H16 Br Cl2 N3 O4
【MolWeight】
549.206
【Inchi】
InChI=1S/C23H16BrCl2N3O4/c24-15-9-10-20(33-23(32)17-6-2-4-8-19(17)26)14(11-15)12-28-29-21(30)13-27-22(31)16-5-1-3-7-18(16)25/h1-12H,13H2,(H,27,31)(H,29,30)/b28-12+
【InChIKey】
InChIKey=PNJMBMBVSFUVOC-KVSWJAHQSA-N
【SMILES】
c1ccc(c(c1)C(=O)NCC(=O)N/N=C/c2cc(ccc2OC(=O)c3ccccc3Cl)Br)Cl
【MOL File】
4-BR-2-(2-(((2-CHLOR….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:2
H bond acceptor:7
XLogP3:4.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
4-BR-2-(2-(((2-CHLOROBENZOYL)AMINO)AC)CARBOHYDRAZONOYL)PHENYL 2-CHLOROBENZOATE.cml