6-amino-4-{2-[(2-chlorophenyl)methoxy]-4-methoxyphenyl}-3-methyl-2H,4H-pyrano[2,3-c]pyrazole-5-carbonitrile

6-amino-4-{2-[(2-chlorophenyl)methoxy]-4-methoxyphenyl}-3-methyl-2H,4H-pyrano[2,3-c]pyrazole-5-carbonitrile

Formula: C22H19ClN4O3

SMILES: COC1=CC=C(C2C3=C(C)NN=C3OC(N)=C2C#N)C(OCC2=CC=CC=C2Cl)=C1

IUPAC: 6-amino-4-{2-[(2-chlorophenyl)methoxy]-4-methoxyphenyl}-3-methyl-2H,4H-pyrano[2,3-c]pyrazole-5-carbonitrile

InChI: InChI=1/C22H19ClN4O3/c1-12-19-20(16(10-24)21(25)30-22(19)27-26-12)15-8-7-14(28-2)9-18(15)29-11-13-5-3-4-6-17(13)23/h3-9,20H,11,25H2,1-2H3,(H,26,27)

Composition: C (62.49%), H (4.53%), Cl (8.38%), N (13.25%), O (11.35%)

Molar Mass: 422.87

Atom Count: 49

Heavy Atom Count: 30

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	1
Exact Mass	422.1145682
Formal Charge	0
FSP3	0.18
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	6
Hydrogen Bond Donor Count	2
InChIKey	LRDRLZXJUYPGRS-UHFFFAOYNA-N
Lipinski's Rule of Five	1
Molar Refractivity	124.58
Topological Polar Surface Area	106.18
Polarizability	43.06
Ring Count	4
Rotatable Bond Count	5

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C22H19ClN4O3		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00