3-(2-chloro-5-iodobenzoyl)-1-{4-[4-(furan-2-carbonyl)piperazin-1-yl]phenyl}thiourea

3-(2-chloro-5-iodobenzoyl)-1-{4-[4-(furan-2-carbonyl)piperazin-1-yl]phenyl}thiourea

Formula: C23H20ClIN4O3S

SMILES: ClC1=CC=C(I)C=C1C(=O)NC(=S)NC1=CC=C(C=C1)N1CCN(CC1)C(=O)C1=CC=CO1

IUPAC: 3-(2-chloro-5-iodobenzoyl)-1-{4-[4-(furan-2-carbonyl)piperazin-1-yl]phenyl}thiourea

InChI: InChI=1S/C23H20ClIN4O3S/c24-19-8-3-15(25)14-18(19)21(30)27-23(33)26-16-4-6-17(7-5-16)28-9-11-29(12-10-28)22(31)20-2-1-13-32-20/h1-8,13-14H,9-12H2,(H2,26,27,30,33)

Composition: C (46.44%), H (3.39%), Cl (5.96%), I (21.33%), N (9.42%), O (8.07%), S (5.39%)

Molar Mass: 594.85

Atom Count: 53

Heavy Atom Count: 33

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	0
Exact Mass	593.99893
Formal Charge	0
FSP3	0.17
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
InChIKey	FDXGNRSYFULMMZ-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity	143.8
Topological Polar Surface Area	77.82
Polarizability	53.28
Ring Count	4
Rotatable Bond Count	4

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C23H20ClIN4O3S		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00