4-[4-(4-nitrophenyl)piperazine-1-carbonyl]-1,2,5-oxadiazol-3-amine

4-[4-(4-nitrophenyl)piperazine-1-carbonyl]-1,2,5-oxadiazol-3-amine

Formula: C13H14N6O4

SMILES: NC1=NON=C1C(=O)N1CCN(CC1)C1=CC=C(C=C1)[N+]([O-])=O

IUPAC: 4-[4-(4-nitrophenyl)piperazine-1-carbonyl]-1,2,5-oxadiazol-3-amine

InChI: InChI=1S/C13H14N6O4/c14-12-11(15-23-16-12)13(20)18-7-5-17(6-8-18)9-1-3-10(4-2-9)19(21)22/h1-4H,5-8H2,(H2,14,16)

Composition: C (49.06%), H (4.43%), N (26.40%), O (20.11%)

Molar Mass: 318.293

Atom Count: 37

Heavy Atom Count: 23

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	318.107652955
Formal Charge	0
FSP3	0.31
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	7
Hydrogen Bond Donor Count	1
InChIKey	OXYNDQGVKMEFCD-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	82.81
Topological Polar Surface Area	131.63
Polarizability	28.87
Ring Count	3
Rotatable Bond Count	3

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C13H14N6O4		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00