3-[4-(4-bromophenyl)-1,3-thiazol-2-yl]pyridine

3-[4-(4-bromophenyl)-1,3-thiazol-2-yl]pyridine

CAS: 70031-93-5

Formula: C14H9BrN2S

SMILES: BrC1=CC=C(C=C1)C1=CSC(=N1)C1=CN=CC=C1

IUPAC: 3-[4-(4-bromophenyl)-1,3-thiazol-2-yl]pyridine

InChI: InChI=1S/C14H9BrN2S/c15-12-5-3-10(4-6-12)13-9-18-14(17-13)11-2-1-7-16-8-11/h1-9H

Composition: C (53.01%), H (2.86%), Br (25.19%), N (8.83%), S (10.11%)

Molar Mass: 317.2

Atom Count: 27

Heavy Atom Count: 18

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	0
Exact Mass	315.966982
Formal Charge	0
FSP3	0
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
InChIKey	LGXAFGTVYJRCNW-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	86.6
Topological Polar Surface Area	25.78
Polarizability	31.09
Ring Count	3
Rotatable Bond Count	2

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90%	<2 Days	70031-93-5		$51.35-$86.31$51.35$63.37$86.31