339020-84-7
N,1-DIMETHYL-3,5-DINITRO-6-[4-(PHENYLSULFONYL)PIPERAZINO]-1,4-DIHYDRO-2-PYRIDINAMINE
NameN,1-DIMETHYL-3,5-DINITRO-6-[4-(PHENYLSULFONYL)PIPERAZINO]-1,4-DIHYDRO-2-PYRIDINAMINE
1Identification
【Name】
N,1-DIMETHYL-3,5-DINITRO-6-[4-(PHENYLSULFONYL)PIPERAZINO]-1,4-DIHYDRO-2-PYRIDINAMINE
【CAS】
【MDL】
MFCD00127604
【English Synonyms】
【Formula】
C17 H22 N6 O6 S
【MolWeight】
438.463
【Inchi】
InChI=1S/C17H22N6O6S/c1-18-16-14(22(24)25)12-15(23(26)27)17(19(16)2)20-8-10-21(11-9-20)30(28,29)13-6-4-3-5-7-13/h3-7,18H,8-12H2,1-2H3
【InChIKey】
InChIKey=DPZIVWPFFOESGS-UHFFFAOYSA-N
【SMILES】
CNC1=C(CC(=C(N1C)N2CCN(CC2)S(=O)(=O)c3ccccc3)[N+](=O)[O-])[N+](=O)[O-]
【MOL File】
N,1-DIMETHYL-3,5-DIN….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:12
XLogP3:0.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
N,1-DIMETHYL-3,5-DINITRO-6-[4-(PHENYLSULFONYL)PIPERAZINO]-1,4-DIHYDRO-2-PYRIDINAMINE.cml