565210-04-0
N-(2,2-DIFLUORO-BENZO[1,3]DIOXOL-5-YL)-2-[4-(4-NITRO-PHENYL)-PIPERAZIN-1-YL]-ACETAMIDE
Name
N-(2,2-DIFLUORO-BENZO[1,3]DIOXOL-5-YL)-2-[4-(4-NITRO-PHENYL)-PIPERAZIN-1-YL]-ACETAMIDE
Formula
C19 H18 F2 N4 O5
MolWeight
420.37
1Identification
【Name】
N-(2,2-DIFLUORO-BENZO[1,3]DIOXOL-5-YL)-2-[4-(4-NITRO-PHENYL)-PIPERAZIN-1-YL]-ACETAMIDE
【CAS】
【MDL】
MFCD04612513
【English Synonyms】
【Formula】
C19 H18 F2 N4 O5
【MolWeight】
420.37
【Inchi】
InChI=1S/C19H18F2N4O5/c20-19(21)29-16-6-1-13(11-17(16)30-19)22-18(26)12-23-7-9-24(10-8-23)14-2-4-15(5-3-14)25(27)28/h1-6,11H,7-10,12H2,(H,22,26)
【InChIKey】
InChIKey=RVLLVJMQUVUIEG-UHFFFAOYSA-N
【SMILES】
c1cc(ccc1N2CCN(CC2)CC(=O)Nc3ccc4c(c3)OC(O4)(F)F)[N+](=O)[O-]
【MOL File】
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:9
XLogP3:3.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
N-(2,2-DIFLUORO-BENZO[1,3]DIOXOL-5-YL)-2-[4-(4-NITRO-PHENYL)-PIPERAZIN-1-YL]-ACETAMIDE.cml
Quick Release
2-(1H-IMIDAZOL-1-YL)-N-[(1-METHYL-1H-IMIDAZOL-2-YL)METHYL]CYCLOPENTAN-1-AMINE
METHYL 4-FLUORO-2-([(1-METHYL-1H-IMIDAZOL-2-YL)METHYL]AMINO)BENZOATE
N-(2-METHYL-5-([(1-METHYL-1H-IMIDAZOL-2-YL)METHYL]AMINO)PHENYL)ACETAMIDE
2-CHLORO-5-([(1-ETHYL-1H-IMIDAZOL-2-YL)METHYL]AMINO)BENZOIC ACID
5-(4,5-DIMETHYL-1H-IMIDAZOL-1-YL)-2-METHYL-2-(METHYLAMINO)PENTANAMIDE
5-(4,5-DIMETHYL-1H-IMIDAZOL-1-YL)-2-METHYL-2-[(PROPAN-2-YL)AMINO]PENTANAMIDE
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