4-(6-{[4-(trifluoromethoxy)phenyl]amino}pyrimidin-4-yl)phenol

4-(6-{[4-(trifluoromethoxy)phenyl]amino}pyrimidin-4-yl)phenol

Formula: C17H12F3N3O2

SMILES: OC1=CC=C(C=C1)C1=CC(NC2=CC=C(OC(F)(F)F)C=C2)=NC=N1

IUPAC: 4-(6-{[4-(trifluoromethoxy)phenyl]amino}pyrimidin-4-yl)phenol

InChI: InChI=1S/C17H12F3N3O2/c18-17(19,20)25-14-7-3-12(4-8-14)23-16-9-15(21-10-22-16)11-1-5-13(24)6-2-11/h1-10,24H,(H,21,22,23)

Composition: C (58.79%), H (3.48%), F (16.41%), N (12.10%), O (9.21%)

Molar Mass: 347.297

Atom Count: 37

Heavy Atom Count: 25

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	0
Exact Mass	347.088161127
Formal Charge	0
FSP3	0.06
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	2
InChIKey	UNNHUSXTCNMGSB-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity	81.34
Topological Polar Surface Area	67.27
Polarizability	32.52
Ring Count	3
Rotatable Bond Count	5

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Purity	LeadTime	Formula		UnitPrice
98%	<10 Days	C17H12F3N3O2		Quote Only