1-{3-[3-(4-chlorophenyl)pyrazolo[1,5-a]pyrimidin-7-yl]phenyl}-3,3-dimethylazetidin-2-one

1-{3-[3-(4-chlorophenyl)pyrazolo[1,5-a]pyrimidin-7-yl]phenyl}-3,3-dimethylazetidin-2-one

CAS: 861210-44-8

Formula: C23H19ClN4O

SMILES: CC1(C)CN(C1=O)C1=CC=CC(=C1)C1=CC=NC2=C(C=NN12)C1=CC=C(Cl)C=C1

IUPAC: 1-{3-[3-(4-chlorophenyl)pyrazolo[1,5-a]pyrimidin-7-yl]phenyl}-3,3-dimethylazetidin-2-one

InChI: InChI=1S/C23H19ClN4O/c1-23(2)14-27(22(23)29)18-5-3-4-16(12-18)20-10-11-25-21-19(13-26-28(20)21)15-6-8-17(24)9-7-15/h3-13H,14H2,1-2H3

Composition: C (68.57%), H (4.75%), Cl (8.80%), N (13.91%), O (3.97%)

Molar Mass: 402.88

Atom Count: 48

Heavy Atom Count: 29

Properties

Properties

Common Names	N/A
Aromatic Ring Count	4
Asymmetric Atom Count	0
Exact Mass	402.1247389
Formal Charge	0
FSP3	0.17
Hetero Ring Count	3
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
InChIKey	FIZOZGOJAYHTKL-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	123.92
Topological Polar Surface Area	50.5
Polarizability	45.85
Ring Count	5
Rotatable Bond Count	3

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Purity	LeadTime	CAS	PacketSize	UnitPrice
90%	<2 Days	861210-44-8		$51.35-$86.31$51.35$63.37$86.31