3-(4-tert-butylbenzoyl)-1-(pyridin-2-yl)thiourea

3-(4-tert-butylbenzoyl)-1-(pyridin-2-yl)thiourea

Formula: C17H19N3OS

SMILES: CC(C)(C)C1=CC=C(C=C1)C(=O)NC(=S)NC1=CC=CC=N1

IUPAC: 3-(4-tert-butylbenzoyl)-1-(pyridin-2-yl)thiourea

InChI: InChI=1S/C17H19N3OS/c1-17(2,3)13-9-7-12(8-10-13)15(21)20-16(22)19-14-6-4-5-11-18-14/h4-11H,1-3H3,(H2,18,19,20,21,22)

Composition: C (65.15%), H (6.11%), N (13.41%), O (5.10%), S (10.23%)

Molar Mass: 313.42

Atom Count: 41

Heavy Atom Count: 22

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	313.124883418
Formal Charge	0
FSP3	0.24
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	2
InChIKey	AMEMVWPSHSVXID-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	94.65
Topological Polar Surface Area	54.02
Polarizability	35.57
Ring Count	2
Rotatable Bond Count	3

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C17H19N3OS		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00