N-(prop-2-en-1-yl)-4-[3-(trifluoromethyl)phenyl]piperazine-1-carbothioamide

N-(prop-2-en-1-yl)-4-[3-(trifluoromethyl)phenyl]piperazine-1-carbothioamide

Formula: C15H18F3N3S

SMILES: FC(F)(F)C1=CC(=CC=C1)N1CCN(CC1)C(=S)NCC=C

IUPAC: N-(prop-2-en-1-yl)-4-[3-(trifluoromethyl)phenyl]piperazine-1-carbothioamide

InChI: InChI=1S/C15H18F3N3S/c1-2-6-19-14(22)21-9-7-20(8-10-21)13-5-3-4-12(11-13)15(16,17)18/h2-5,11H,1,6-10H2,(H,19,22)

Composition: C (54.70%), H (5.51%), F (17.30%), N (12.76%), S (9.73%)

Molar Mass: 329.39

Atom Count: 40

Heavy Atom Count: 22

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	329.117353255
Formal Charge	0
FSP3	0.4
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	1
InChIKey	DJBARJXKFZWMOY-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	87.51
Topological Polar Surface Area	18.51
Polarizability	31.92
Ring Count	2
Rotatable Bond Count	4

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C15H18F3N3S		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00