769151-36-2
4-(2-(((2-METHYLBENZOYL)AMINO)AC)CARBOHYDRAZONOYL)PHENYL 2,4-DICHLOROBENZOATE
Name4-(2-(((2-METHYLBENZOYL)AMINO)AC)CARBOHYDRAZONOYL)PHENYL 2,4-DICHLOROBENZOATE
1Identification
【Name】
4-(2-(((2-METHYLBENZOYL)AMINO)AC)CARBOHYDRAZONOYL)PHENYL 2,4-DICHLOROBENZOATE
【CAS】
【MDL】
MFCD05153691
【English Synonyms】
【Formula】
C24 H19 Cl2 N3 O4
【MolWeight】
484.337
【Inchi】
InChI=1S/C24H19Cl2N3O4/c1-15-4-2-3-5-19(15)23(31)27-14-22(30)29-28-13-16-6-9-18(10-7-16)33-24(32)20-11-8-17(25)12-21(20)26/h2-13H,14H2,1H3,(H,27,31)(H,29,30)/b28-13+
【InChIKey】
InChIKey=PQJQEFCOCXFSRS-XODNFHPESA-N
【SMILES】
Cc1ccccc1C(=O)NCC(=O)N/N=C/c2ccc(cc2)OC(=O)c3ccc(cc3Cl)Cl
【MOL File】
4-(2-(((2-METHYLBENZ….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-(2-(((2-METHYLBENZOYL)AMINO)AC)CARBOHYDRAZONOYL)PHENYL 2,4-DICHLOROBENZOATE.cml