1-(4-fluorophenyl)-3-(4-methylpiperazin-1-yl)thiourea

1-(4-fluorophenyl)-3-(4-methylpiperazin-1-yl)thiourea

Formula: C12H17FN4S

SMILES: CN1CCN(CC1)NC(=S)NC1=CC=C(F)C=C1

IUPAC: 1-(4-fluorophenyl)-3-(4-methylpiperazin-1-yl)thiourea

InChI: InChI=1S/C12H17FN4S/c1-16-6-8-17(9-7-16)15-12(18)14-11-4-2-10(13)3-5-11/h2-5H,6-9H2,1H3,(H2,14,15,18)

Composition: C (53.71%), H (6.39%), F (7.08%), N (20.88%), S (11.95%)

Molar Mass: 268.35

Atom Count: 35

Heavy Atom Count: 18

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	268.1157959
Formal Charge	0
FSP3	0.42
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	2
InChIKey	GBZMAIHZVPIEKG-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	76.95
Topological Polar Surface Area	30.54
Polarizability	28.96
Ring Count	2
Rotatable Bond Count	2

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C12H17FN4S		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00