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

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

Formula: C21H16N4O2S

SMILES: CC1=CC(=CC=C1)C(=O)NC(=S)NC1=CC=CC(=C1)C1=NC2=NC=CC=C2O1

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

InChI: InChI=1S/C21H16N4O2S/c1-13-5-2-6-14(11-13)19(26)25-21(28)23-16-8-3-7-15(12-16)20-24-18-17(27-20)9-4-10-22-18/h2-12H,1H3,(H2,23,25,26,28)

Composition: C (64.93%), H (4.15%), N (14.42%), O (8.24%), S (8.25%)

Molar Mass: 388.45

Atom Count: 44

Heavy Atom Count: 28

Properties

Properties

Common Names	N/A
Aromatic Ring Count	4
Asymmetric Atom Count	0
Exact Mass	388.099396945
Formal Charge	0
FSP3	0.05
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
InChIKey	OCNINUNUILSGKF-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	124.05
Topological Polar Surface Area	80.05
Polarizability	43.16
Ring Count	4
Rotatable Bond Count	3

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C21H16N4O2S		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00