1-(4-tert-butylbenzoyl)-3-[2-(naphthalen-1-yl)-1,3-benzoxazol-5-yl]thiourea

1-(4-tert-butylbenzoyl)-3-[2-(naphthalen-1-yl)-1,3-benzoxazol-5-yl]thiourea

Formula: C29H25N3O2S

SMILES: CC(C)(C)C1=CC=C(C=C1)C(=O)NC(=S)NC1=CC=C2OC(=NC2=C1)C1=CC=CC2=CC=CC=C12

IUPAC: 1-(4-tert-butylbenzoyl)-3-[2-(naphthalen-1-yl)-1,3-benzoxazol-5-yl]thiourea

InChI: InChI=1S/C29H25N3O2S/c1-29(2,3)20-13-11-19(12-14-20)26(33)32-28(35)30-21-15-16-25-24(17-21)31-27(34-25)23-10-6-8-18-7-4-5-9-22(18)23/h4-17H,1-3H3,(H2,30,32,33,35)

Composition: C (72.63%), H (5.25%), N (8.76%), O (6.67%), S (6.68%)

Molar Mass: 479.6

Atom Count: 60

Heavy Atom Count: 35

Properties

Properties

Common Names	N/A
Aromatic Ring Count	5
Asymmetric Atom Count	0
Exact Mass	479.166748231
Formal Charge	0
FSP3	0.14
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	2
InChIKey	ZUHUKQCDSKBFCY-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity	154.71
Topological Polar Surface Area	67.16
Polarizability	57.88
Ring Count	5
Rotatable Bond Count	4

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C29H25N3O2S		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00