3-[2-(2,4-dichlorophenyl)-1,3-benzoxazol-5-yl]-1-(4-ethoxybenzoyl)thiourea

3-[2-(2,4-dichlorophenyl)-1,3-benzoxazol-5-yl]-1-(4-ethoxybenzoyl)thiourea

Formula: C23H17Cl2N3O3S

SMILES: CCOC1=CC=C(C=C1)C(=O)NC(=S)NC1=CC=C2OC(=NC2=C1)C1=CC=C(Cl)C=C1Cl

IUPAC: 3-[2-(2,4-dichlorophenyl)-1,3-benzoxazol-5-yl]-1-(4-ethoxybenzoyl)thiourea

InChI: InChI=1S/C23H17Cl2N3O3S/c1-2-30-16-7-3-13(4-8-16)21(29)28-23(32)26-15-6-10-20-19(12-15)27-22(31-20)17-9-5-14(24)11-18(17)25/h3-12H,2H2,1H3,(H2,26,28,29,32)

Composition: C (56.80%), H (3.52%), Cl (14.58%), N (8.64%), O (9.87%), S (6.59%)

Molar Mass: 486.37

Atom Count: 49

Heavy Atom Count: 32

Properties

Properties

Common Names	N/A
Aromatic Ring Count	4
Asymmetric Atom Count	0
Exact Mass	485.036768
Formal Charge	0
FSP3	0.09
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
InChIKey	MWPHVUCCXDLBCG-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity	140.41
Topological Polar Surface Area	76.39
Polarizability	51.05
Ring Count	4
Rotatable Bond Count	5

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C23H17Cl2N3O3S		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00