6-(4-chlorophenyl)-2-(morpholin-4-yl)-4-(trifluoromethyl)pyridine-3-carbonitrile

6-(4-chlorophenyl)-2-(morpholin-4-yl)-4-(trifluoromethyl)pyridine-3-carbonitrile

CAS: 338749-81-8

Formula: C17H13ClF3N3O

SMILES: FC(F)(F)C1=CC(=NC(N2CCOCC2)=C1C#N)C1=CC=C(Cl)C=C1

IUPAC: 6-(4-chlorophenyl)-2-(morpholin-4-yl)-4-(trifluoromethyl)pyridine-3-carbonitrile

InChI: InChI=1S/C17H13ClF3N3O/c18-12-3-1-11(2-4-12)15-9-14(17(19,20)21)13(10-22)16(23-15)24-5-7-25-8-6-24/h1-4,9H,5-8H2

Composition: C (55.52%), H (3.56%), Cl (9.64%), F (15.50%), N (11.43%), O (4.35%)

Molar Mass: 367.76

Atom Count: 38

Heavy Atom Count: 25

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	367.0699242
Formal Charge	0
FSP3	0.29
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
InChIKey	QHFHBNAQKMWIPI-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	88.98
Topological Polar Surface Area	49.15
Polarizability	33.61
Ring Count	3
Rotatable Bond Count	3

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90%	<2 Days	338749-81-8		$51.35-$524.40$51.35$63.37$86.31$524.40