3-[4-(3-fluoropropoxy)phenyl]-N-[2-(pyridin-3-yl)pyrimidin-4-yl]prop-2-enamide

3-[4-(3-fluoropropoxy)phenyl]-N-[2-(pyridin-3-yl)pyrimidin-4-yl]prop-2-enamide

CAS: 478046-38-7

Formula: C21H19FN4O2

SMILES: FCCCOC1=CC=C(C=CC(=O)NC2=NC(=NC=C2)C2=CN=CC=C2)C=C1

IUPAC: 3-[4-(3-fluoropropoxy)phenyl]-N-[2-(pyridin-3-yl)pyrimidin-4-yl]prop-2-enamide

InChI: InChI=1S/C21H19FN4O2/c22-11-2-14-28-18-7-4-16(5-8-18)6-9-20(27)25-19-10-13-24-21(26-19)17-3-1-12-23-15-17/h1,3-10,12-13,15H,2,11,14H2,(H,24,25,26,27)

Composition: C (66.66%), H (5.06%), F (5.02%), N (14.81%), O (8.46%)

Molar Mass: 378.407

Atom Count: 47

Heavy Atom Count: 28

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	0
Exact Mass	378.149204031
Formal Charge	0
FSP3	0.14
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	1
InChIKey	WAGXXOADNJFZNO-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	117.5
Topological Polar Surface Area	77
Polarizability	39.88
Ring Count	3
Rotatable Bond Count	8

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Purity	LeadTime	CAS	PacketSize	UnitPrice
90%	<2 Days	478046-38-7		$51.35-$524.40$51.35$63.37$86.31$524.40