1-(4-chlorophenyl)-3-(3-methylbutanoyl)thiourea

1-(4-chlorophenyl)-3-(3-methylbutanoyl)thiourea

Formula: C12H15ClN2OS

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

IUPAC: 1-(4-chlorophenyl)-3-(3-methylbutanoyl)thiourea

InChI: InChI=1S/C12H15ClN2OS/c1-8(2)7-11(16)15-12(17)14-10-5-3-9(13)4-6-10/h3-6,8H,7H2,1-2H3,(H2,14,15,16,17)

Composition: C (53.23%), H (5.58%), Cl (13.09%), N (10.35%), O (5.91%), S (11.84%)

Molar Mass: 270.78

Atom Count: 32

Heavy Atom Count: 17

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	270.059362
Formal Charge	0
FSP3	0.33
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	2
InChIKey	TXQDUOXTWJHPAA-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	75.74
Topological Polar Surface Area	41.13
Polarizability	29.01
Ring Count	1
Rotatable Bond Count	3

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C12H15ClN2OS		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00