1-benzoyl-3-[2-(4-methylphenyl)-1,3-benzoxazol-5-yl]thiourea

1-benzoyl-3-[2-(4-methylphenyl)-1,3-benzoxazol-5-yl]thiourea

Formula: C22H17N3O2S

SMILES: CC1=CC=C(C=C1)C1=NC2=CC(NC(=S)NC(=O)C3=CC=CC=C3)=CC=C2O1

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

InChI: InChI=1S/C22H17N3O2S/c1-14-7-9-16(10-8-14)21-24-18-13-17(11-12-19(18)27-21)23-22(28)25-20(26)15-5-3-2-4-6-15/h2-13H,1H3,(H2,23,25,26,28)

Composition: C (68.20%), H (4.42%), N (10.85%), O (8.26%), S (8.27%)

Molar Mass: 387.46

Atom Count: 45

Heavy Atom Count: 28

Properties

Properties

Common Names	N/A
Aromatic Ring Count	4
Asymmetric Atom Count	0
Exact Mass	387.104147973
Formal Charge	0
FSP3	0.05
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	2
InChIKey	AQHPBXQEVLIJCD-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity	124.63
Topological Polar Surface Area	67.16
Polarizability	44.75
Ring Count	4
Rotatable Bond Count	3

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C22H17N3O2S		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00