3-(3-chloro-4-fluorophenyl)-1-(4-chlorophenyl)thiourea

3-(3-chloro-4-fluorophenyl)-1-(4-chlorophenyl)thiourea

CAS: 298215-85-7

Formula: C13H9Cl2FN2S

SMILES: FC1=C(Cl)C=C(NC(=S)NC2=CC=C(Cl)C=C2)C=C1

IUPAC: 3-(3-chloro-4-fluorophenyl)-1-(4-chlorophenyl)thiourea

InChI: InChI=1S/C13H9Cl2FN2S/c14-8-1-3-9(4-2-8)17-13(19)18-10-5-6-12(16)11(15)7-10/h1-7H,(H2,17,18,19)

Composition: C (49.54%), H (2.88%), Cl (22.49%), F (6.03%), N (8.89%), S (10.17%)

Molar Mass: 315.19

Atom Count: 28

Heavy Atom Count: 19

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	313.984753
Formal Charge	0
FSP3	0
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	0
Hydrogen Bond Donor Count	2
InChIKey	AWHOZNZKIQAJCD-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity	83.87
Topological Polar Surface Area	24.06
Polarizability	30.9
Ring Count	2
Rotatable Bond Count	2

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90%	<2 Days	298215-85-7		$51.35-$86.31$51.35$63.37$86.31