3-[2-(2,3,4,5,6-pentafluorophenyl)-1,3-benzoxazol-5-yl]-1-(2-phenylacetyl)thiourea

3-[2-(2,3,4,5,6-pentafluorophenyl)-1,3-benzoxazol-5-yl]-1-(2-phenylacetyl)thiourea

Formula: C22H12F5N3O2S

SMILES: FC1=C(F)C(F)=C(C2=NC3=CC(NC(=S)NC(=O)CC4=CC=CC=C4)=CC=C3O2)C(F)=C1F

IUPAC: 3-[2-(2,3,4,5,6-pentafluorophenyl)-1,3-benzoxazol-5-yl]-1-(2-phenylacetyl)thiourea

InChI: InChI=1S/C22H12F5N3O2S/c23-16-15(17(24)19(26)20(27)18(16)25)21-29-12-9-11(6-7-13(12)32-21)28-22(33)30-14(31)8-10-4-2-1-3-5-10/h1-7,9H,8H2,(H2,28,30,31,33)

Composition: C (55.35%), H (2.53%), F (19.90%), N (8.80%), O (6.70%), S (6.72%)

Molar Mass: 477.41

Atom Count: 45

Heavy Atom Count: 33

Properties

Properties

Common Names	N/A
Aromatic Ring Count	4
Asymmetric Atom Count	0
Exact Mass	477.057038627
Formal Charge	0
FSP3	0.05
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	2
InChIKey	HWLLLGAHILZLRU-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity	124.73
Topological Polar Surface Area	67.16
Polarizability	43.48
Ring Count	4
Rotatable Bond Count	4

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C22H12F5N3O2S		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00