N2-(3-chlorophenyl)-N4-(4-fluorophenyl)-5-nitropyrimidine-2,4,6-triamine

N2-(3-chlorophenyl)-N4-(4-fluorophenyl)-5-nitropyrimidine-2,4,6-triamine

Formula: C16H12ClFN6O2

SMILES: NC1=C(C(NC2=CC=C(F)C=C2)=NC(NC2=CC=CC(Cl)=C2)=N1)[N+]([O-])=O

IUPAC: N2-(3-chlorophenyl)-N4-(4-fluorophenyl)-5-nitropyrimidine-2,4,6-triamine

InChI: InChI=1S/C16H12ClFN6O2/c17-9-2-1-3-12(8-9)21-16-22-14(19)13(24(25)26)15(23-16)20-11-6-4-10(18)5-7-11/h1-8H,(H4,19,20,21,22,23)

Composition: C (51.28%), H (3.23%), Cl (9.46%), F (5.07%), N (22.43%), O (8.54%)

Molar Mass: 374.76

Atom Count: 38

Heavy Atom Count: 26

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	0
Exact Mass	374.0694295
Formal Charge	0
FSP3	0
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	7
Hydrogen Bond Donor Count	3
InChIKey	HBKLQRAJOLXIBA-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity	96.31
Topological Polar Surface Area	119
Polarizability	34.68
Ring Count	3
Rotatable Bond Count	5

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C16H12ClFN6O2		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00