N-(oxan-4-yl)-4-{4-[3-(pyridin-2-yl)-1H-pyrazol-4-yl]pyridin-2-yl}benzamide

N-(oxan-4-yl)-4-{4-[3-(pyridin-2-yl)-1H-pyrazol-4-yl]pyridin-2-yl}benzamide

CAS: 452342-67-5

Formula: C25H23N5O2

SMILES: O=C(NC1CCOCC1)C1=CC=C(C=C1)C1=NC=CC(=C1)C1=CNN=C1C1=NC=CC=C1

IUPAC: N-(oxan-4-yl)-4-{4-[3-(pyridin-2-yl)-1H-pyrazol-4-yl]pyridin-2-yl}benzamide

InChI: InChI=1S/C25H23N5O2/c31-25(29-20-9-13-32-14-10-20)18-6-4-17(5-7-18)23-15-19(8-12-27-23)21-16-28-30-24(21)22-3-1-2-11-26-22/h1-8,11-12,15-16,20H,9-10,13-14H2,(H,28,30)(H,29,31)

Composition: C (70.57%), H (5.45%), N (16.46%), O (7.52%)

Molar Mass: 425.492

Atom Count: 55

Heavy Atom Count: 32

Properties

Properties

Common Names	N/A
Aromatic Ring Count	4
Asymmetric Atom Count	0
Exact Mass	425.185175001
Formal Charge	0
FSP3	0.2
Hetero Ring Count	4
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	2
InChIKey	SAGZIBJAQGBRQA-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	122.17
Topological Polar Surface Area	92.79
Polarizability	50.28
Ring Count	5
Rotatable Bond Count	5

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