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

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

Formula: C23H20N4O4S

SMILES: COC1=CC=C(C=C1OC)C(=O)NC(=S)NC1=CC(=CC=C1C)C1=NC2=NC=CC=C2O1

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

InChI: InChI=1S/C23H20N4O4S/c1-13-6-7-15(22-26-20-18(31-22)5-4-10-24-20)11-16(13)25-23(32)27-21(28)14-8-9-17(29-2)19(12-14)30-3/h4-12H,1-3H3,(H2,25,27,28,32)

Composition: C (61.60%), H (4.50%), N (12.49%), O (14.27%), S (7.15%)

Molar Mass: 448.5

Atom Count: 52

Heavy Atom Count: 32

Properties

Properties

Common Names	N/A
Aromatic Ring Count	4
Asymmetric Atom Count	0
Exact Mass	448.120526314
Formal Charge	0
FSP3	0.13
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	2
InChIKey	RORZAWXLCAPRCY-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	136.98
Topological Polar Surface Area	98.51
Polarizability	48.18
Ring Count	4
Rotatable Bond Count	5

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C23H20N4O4S		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00