N-{[5-(3-chloro-4-fluorophenyl)furan-2-yl]methyl}-1H-1,2,4-triazol-3-amine

N-{[5-(3-chloro-4-fluorophenyl)furan-2-yl]methyl}-1H-1,2,4-triazol-3-amine

Formula: C13H10ClFN4O

SMILES: FC1=CC=C(C=C1Cl)C1=CC=C(CNC2=NNC=N2)O1

IUPAC: N-{[5-(3-chloro-4-fluorophenyl)furan-2-yl]methyl}-1H-1,2,4-triazol-3-amine

InChI: InChI=1S/C13H10ClFN4O/c14-10-5-8(1-3-11(10)15)12-4-2-9(20-12)6-16-13-17-7-18-19-13/h1-5,7H,6H2,(H2,16,17,18,19)

Composition: C (53.35%), H (3.44%), Cl (12.11%), F (6.49%), N (19.14%), O (5.47%)

Molar Mass: 292.7

Atom Count: 30

Heavy Atom Count: 20

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	0
Exact Mass	292.0527168
Formal Charge	0
FSP3	0.08
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
InChIKey	AWUMHIBGGBYWMB-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	76.1
Topological Polar Surface Area	66.74
Polarizability	28.24
Ring Count	3
Rotatable Bond Count	4

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C13H10ClFN4O		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00