59467-62-8
7-CHLORO-5-(2-FLUOROPHENYL)-2-(N-NITROSOMETHYLAMINO)-3H-1,4-BENZODIAZEPINE
Name
7-CHLORO-5-(2-FLUOROPHENYL)-2-(N-NITROSOMETHYLAMINO)-3H-1,4-BENZODIAZEPINE
Formula
C16 H12 Cl F N4 O
MolWeight
330.749
1Identification
【Name】
7-CHLORO-5-(2-FLUOROPHENYL)-2-(N-NITROSOMETHYLAMINO)-3H-1,4-BENZODIAZEPINE
【CAS】
【MDL】
MFCD09753618
【English Synonyms】
【Formula】
C16 H12 Cl F N4 O
【MolWeight】
330.749
【Inchi】
InChI=1S/C16H12ClFN4O/c17-10-5-6-14-12(7-10)16(11-3-1-2-4-13(11)18)19-8-15(22-14)20-9-21-23/h1-7H,8-9H2,(H,20,22)
【InChIKey】
InChIKey=BWFAXYPBHCHERA-UHFFFAOYSA-N
【SMILES】
c1ccc(c(c1)C2=NCC(=Nc3c2cc(cc3)Cl)NCN=O)F
【MOL File】
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:5
XLogP3:2.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
7-CHLORO-5-(2-FLUOROPHENYL)-2-(N-NITROSOMETHYLAMINO)-3H-1,4-BENZODIAZEPINE.cml
Quick Release
17-AAG
75747-14-7
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