4-(morpholin-4-yl)-6-phenyl-2-(pyridin-3-yl)pyrimidine-5-carbonitrile

4-(morpholin-4-yl)-6-phenyl-2-(pyridin-3-yl)pyrimidine-5-carbonitrile

CAS: 320417-69-4

Formula: C20H17N5O

SMILES: N#CC1=C(N=C(N=C1N1CCOCC1)C1=CN=CC=C1)C1=CC=CC=C1

IUPAC: 4-(morpholin-4-yl)-6-phenyl-2-(pyridin-3-yl)pyrimidine-5-carbonitrile

InChI: InChI=1S/C20H17N5O/c21-13-17-18(15-5-2-1-3-6-15)23-19(16-7-4-8-22-14-16)24-20(17)25-9-11-26-12-10-25/h1-8,14H,9-12H2

Composition: C (69.96%), H (4.99%), N (20.40%), O (4.66%)

Molar Mass: 343.39

Atom Count: 43

Heavy Atom Count: 26

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	0
Exact Mass	343.143310187
Formal Charge	0
FSP3	0.2
Hetero Ring Count	3
Hydrogen Bond Acceptor Count	6
Hydrogen Bond Donor Count	0
InChIKey	HORSLSDSHRJGDD-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	110.28
Topological Polar Surface Area	74.93
Polarizability	39.2
Ring Count	4
Rotatable Bond Count	3

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