1-[5-(1,3-benzoxazol-2-yl)-2-chlorophenyl]-3-(3-methoxybenzoyl)thiourea

1-[5-(1,3-benzoxazol-2-yl)-2-chlorophenyl]-3-(3-methoxybenzoyl)thiourea

Formula: C22H16ClN3O3S

SMILES: COC1=CC=CC(=C1)C(=O)NC(=S)NC1=CC(=CC=C1Cl)C1=NC2=CC=CC=C2O1

IUPAC: 1-[5-(1,3-benzoxazol-2-yl)-2-chlorophenyl]-3-(3-methoxybenzoyl)thiourea

InChI: InChI=1S/C22H16ClN3O3S/c1-28-15-6-4-5-13(11-15)20(27)26-22(30)25-18-12-14(9-10-16(18)23)21-24-17-7-2-3-8-19(17)29-21/h2-12H,1H3,(H2,25,26,27,30)

Composition: C (60.34%), H (3.68%), Cl (8.10%), N (9.60%), O (10.96%), S (7.32%)

Molar Mass: 437.9

Atom Count: 46

Heavy Atom Count: 30

Properties

Properties

Common Names	N/A
Aromatic Ring Count	4
Asymmetric Atom Count	0
Exact Mass	437.0600903
Formal Charge	0
FSP3	0.05
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
InChIKey	VJPJJFYDVIEQAV-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity	130.86
Topological Polar Surface Area	76.39
Polarizability	47.34
Ring Count	4
Rotatable Bond Count	4

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C22H16ClN3O3S		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00