3-[2-(4-ethylphenoxy)acetyl]-1-{4-[4-(furan-2-carbonyl)piperazin-1-yl]phenyl}thiourea

3-[2-(4-ethylphenoxy)acetyl]-1-{4-[4-(furan-2-carbonyl)piperazin-1-yl]phenyl}thiourea

Formula: C26H28N4O4S

SMILES: CCC1=CC=C(OCC(=O)NC(=S)NC2=CC=C(C=C2)N2CCN(CC2)C(=O)C2=CC=CO2)C=C1

IUPAC: 3-[2-(4-ethylphenoxy)acetyl]-1-{4-[4-(furan-2-carbonyl)piperazin-1-yl]phenyl}thiourea

InChI: InChI=1S/C26H28N4O4S/c1-2-19-5-11-22(12-6-19)34-18-24(31)28-26(35)27-20-7-9-21(10-8-20)29-13-15-30(16-14-29)25(32)23-4-3-17-33-23/h3-12,17H,2,13-16,18H2,1H3,(H2,27,28,31,35)

Composition: C (63.40%), H (5.73%), N (11.37%), O (12.99%), S (6.51%)

Molar Mass: 492.59

Atom Count: 63

Heavy Atom Count: 35

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	0
Exact Mass	492.183126572
Formal Charge	0
FSP3	0.27
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	2
InChIKey	UUKXHBULYXKSMC-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	140.57
Topological Polar Surface Area	87.05
Polarizability	52.59
Ring Count	4
Rotatable Bond Count	7

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C26H28N4O4S		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00