1-{[(4-fluorophenyl)methyl]sulfanyl}-4-methylphthalazine

1-{[(4-fluorophenyl)methyl]sulfanyl}-4-methylphthalazine

Formula: C16H13FN2S

SMILES: CC1=C2C=CC=CC2=C(SCC2=CC=C(F)C=C2)N=N1

IUPAC: 1-{[(4-fluorophenyl)methyl]sulfanyl}-4-methylphthalazine

InChI: InChI=1S/C16H13FN2S/c1-11-14-4-2-3-5-15(14)16(19-18-11)20-10-12-6-8-13(17)9-7-12/h2-9H,10H2,1H3

Composition: C (67.58%), H (4.61%), F (6.68%), N (9.85%), S (11.27%)

Molar Mass: 284.35

Atom Count: 33

Heavy Atom Count: 20

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	0
Exact Mass	284.078347764
Formal Charge	0
FSP3	0.12
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
InChIKey	ZABZKYGHWIGUIE-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	82.76
Topological Polar Surface Area	25.78
Polarizability	31.98
Ring Count	3
Rotatable Bond Count	3

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C16H13FN2S		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00