2-{2-[(4-fluorophenyl)sulfanyl]pyridin-3-yl}-1,3-benzothiazole

2-{2-[(4-fluorophenyl)sulfanyl]pyridin-3-yl}-1,3-benzothiazole

CAS: 337920-51-1

Formula: C18H11FN2S2

SMILES: FC1=CC=C(SC2=C(C=CC=N2)C2=NC3=CC=CC=C3S2)C=C1

IUPAC: 2-{2-[(4-fluorophenyl)sulfanyl]pyridin-3-yl}-1,3-benzothiazole

InChI: InChI=1S/C18H11FN2S2/c19-12-7-9-13(10-8-12)22-17-14(4-3-11-20-17)18-21-15-5-1-2-6-16(15)23-18/h1-11H

Composition: C (63.88%), H (3.28%), F (5.61%), N (8.28%), S (18.95%)

Molar Mass: 338.42

Atom Count: 34

Heavy Atom Count: 23

Properties

Properties

Common Names	N/A
Aromatic Ring Count	4
Asymmetric Atom Count	0
Exact Mass	338.034768873
Formal Charge	0
FSP3	0
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
InChIKey	JXRQSUMHLRWBIR-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity	103.29
Topological Polar Surface Area	25.78
Polarizability	37.31
Ring Count	4
Rotatable Bond Count	3

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90%	<2 Days	337920-51-1		$51.35-$86.31$51.35$63.37$86.31