4-(furan-2-ylmethyl)-N-[(4-methylphenyl)methyl]piperazine-1-carbothioamide

4-(furan-2-ylmethyl)-N-[(4-methylphenyl)methyl]piperazine-1-carbothioamide

Formula: C18H23N3OS

SMILES: CC1=CC=C(CNC(=S)N2CCN(CC3=CC=CO3)CC2)C=C1

IUPAC: 4-[(furan-2-yl)methyl]-N-[(4-methylphenyl)methyl]piperazine-1-carbothioamide

InChI: InChI=1S/C18H23N3OS/c1-15-4-6-16(7-5-15)13-19-18(23)21-10-8-20(9-11-21)14-17-3-2-12-22-17/h2-7,12H,8-11,13-14H2,1H3,(H,19,23)

Composition: C (65.62%), H (7.04%), N (12.75%), O (4.86%), S (9.73%)

Molar Mass: 329.46

Atom Count: 46

Heavy Atom Count: 23

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	329.156183547
Formal Charge	0
FSP3	0.39
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	1
InChIKey	OYVXWVYADOANJJ-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	98.53
Topological Polar Surface Area	31.65
Polarizability	37.96
Ring Count	3
Rotatable Bond Count	4

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C18H23N3OS		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00