4-{4-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]-1,3-thiazol-2-yl}morpholine

4-{4-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]-1,3-thiazol-2-yl}morpholine

CAS: 2058814-39-2

Formula: C13H11ClF3N3OS

SMILES: FC(F)(F)C1=CC(Cl)=C(N=C1)C1=CSC(=N1)N1CCOCC1

IUPAC: 4-{4-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]-1,3-thiazol-2-yl}morpholine

InChI: InChI=1S/C13H11ClF3N3OS/c14-9-5-8(13(15,16)17)6-18-11(9)10-7-22-12(19-10)20-1-3-21-4-2-20/h5-7H,1-4H2

Composition: C (44.64%), H (3.17%), Cl (10.14%), F (16.30%), N (12.01%), O (4.57%), S (9.17%)

Molar Mass: 349.76

Atom Count: 33

Heavy Atom Count: 22

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	349.0263453
Formal Charge	0
FSP3	0.38
Hetero Ring Count	3
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
InChIKey	MPDIQKRWMYFMEQ-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	77.26
Topological Polar Surface Area	38.25
Polarizability	29.77
Ring Count	3
Rotatable Bond Count	3

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90%	<2 Days	2058814-39-2		$51.35-$86.31$51.35$63.37$86.31