3-(2-iodobenzoyl)-1-(4-{[1,3]oxazolo[4,5-b]pyridin-2-yl}phenyl)thiourea

3-(2-iodobenzoyl)-1-(4-{[1,3]oxazolo[4,5-b]pyridin-2-yl}phenyl)thiourea

Formula: C20H13IN4O2S

SMILES: IC1=CC=CC=C1C(=O)NC(=S)NC1=CC=C(C=C1)C1=NC2=NC=CC=C2O1

IUPAC: 3-(2-iodobenzoyl)-1-(4-{[1,3]oxazolo[4,5-b]pyridin-2-yl}phenyl)thiourea

InChI: InChI=1S/C20H13IN4O2S/c21-15-5-2-1-4-14(15)18(26)25-20(28)23-13-9-7-12(8-10-13)19-24-17-16(27-19)6-3-11-22-17/h1-11H,(H2,23,25,26,28)

Composition: C (48.01%), H (2.62%), I (25.36%), N (11.20%), O (6.40%), S (6.41%)

Molar Mass: 500.31

Atom Count: 41

Heavy Atom Count: 28

Properties

Properties

Common Names	N/A
Aromatic Ring Count	4
Asymmetric Atom Count	0
Exact Mass	499.98039
Formal Charge	0
FSP3	0
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
InChIKey	LUCHDCLCRYQFHN-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity	132.37
Topological Polar Surface Area	80.05
Polarizability	46.38
Ring Count	4
Rotatable Bond Count	3

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C20H13IN4O2S		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00