765904-28-7
3(2-(((3,4,5-TRIMETHOXYBENZOYL)AMINO)AC)CARBOHYDRAZONOYL)PH 2,4-DICHLOROBENZOATE
Name3(2-(((3,4,5-TRIMETHOXYBENZOYL)AMINO)AC)CARBOHYDRAZONOYL)PH 2,4-DICHLOROBENZOATE
1Identification
【Name】
3(2-(((3,4,5-TRIMETHOXYBENZOYL)AMINO)AC)CARBOHYDRAZONOYL)PH 2,4-DICHLOROBENZOATE
【CAS】
【MDL】
MFCD06199928
【English Synonyms】
【Formula】
C26 H23 Cl2 N3 O7
【MolWeight】
560.388
【Inchi】
InChI=1S/C26H23Cl2N3O7/c1-35-21-10-16(11-22(36-2)24(21)37-3)25(33)29-14-23(32)31-30-13-15-5-4-6-18(9-15)38-26(34)19-8-7-17(27)12-20(19)28/h4-13H,14H2,1-3H3,(H,29,33)(H,31,32)/b30-13+
【InChIKey】
InChIKey=ZQSCQJZFULGYQU-VVEOGCPPSA-N
【SMILES】
COc1cc(cc(c1OC)OC)C(=O)NCC(=O)N/N=C/c2cccc(c2)OC(=O)c3ccc(cc3Cl)Cl
【MOL File】
3(2-(((3,4,5-TRIMETH….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:2
H bond acceptor:10
XLogP3:3.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
3(2-(((3,4,5-TRIMETHOXYBENZOYL)AMINO)AC)CARBOHYDRAZONOYL)PH 2,4-DICHLOROBENZOATE.cml