3-{4-[4-(furan-2-carbonyl)piperazin-1-yl]phenyl}-1-[(2E)-3-phenylprop-2-enoyl]thiourea

3-{4-[4-(furan-2-carbonyl)piperazin-1-yl]phenyl}-1-[(2E)-3-phenylprop-2-enoyl]thiourea

Formula: C25H24N4O3S

SMILES: O=C(NC(=S)NC1=CC=C(C=C1)N1CCN(CC1)C(=O)C1=CC=CO1)C=CC1=CC=CC=C1

IUPAC: 3-{4-[4-(furan-2-carbonyl)piperazin-1-yl]phenyl}-1-[(2E)-3-phenylprop-2-enoyl]thiourea

InChI: InChI=1S/C25H24N4O3S/c30-23(13-8-19-5-2-1-3-6-19)27-25(33)26-20-9-11-21(12-10-20)28-14-16-29(17-15-28)24(31)22-7-4-18-32-22/h1-13,18H,14-17H2,(H2,26,27,30,33)/b13-8+

Composition: C (65.20%), H (5.25%), N (12.17%), O (10.42%), S (6.96%)

Molar Mass: 460.55

Atom Count: 57

Heavy Atom Count: 33

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	0
Exact Mass	460.156911823
Formal Charge	0
FSP3	0.16
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
InChIKey	HRPWOGNWUUQVSW-MDWZMJQESA-N
Lipinski's Rule of Five	1
Molar Refractivity	135.38
Topological Polar Surface Area	77.82
Polarizability	49.9
Ring Count	4
Rotatable Bond Count	5

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C25H24N4O3S		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00