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

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

Formula: C26H21N5O2S

SMILES: COC1=CC=C(C=C1CSC1=CC=CC=N1)C1C2=C(NN=C2OC(N)=C1C#N)C1=CC=CC=C1

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

InChI: InChI=1/C26H21N5O2S/c1-32-20-11-10-17(13-18(20)15-34-21-9-5-6-12-29-21)22-19(14-27)25(28)33-26-23(22)24(30-31-26)16-7-3-2-4-8-16/h2-13,22H,15,28H2,1H3,(H,30,31)

Composition: C (66.79%), H (4.53%), N (14.98%), O (6.84%), S (6.86%)

Molar Mass: 467.55

Atom Count: 55

Heavy Atom Count: 34

Properties

Properties

Common Names	N/A
Aromatic Ring Count	4
Asymmetric Atom Count	1
Exact Mass	467.14159611
Formal Charge	0
FSP3	0.12
Hetero Ring Count	3
Hydrogen Bond Acceptor Count	6
Hydrogen Bond Donor Count	2
InChIKey	QYSNUHCOKGOUDO-UHFFFAOYNA-N
Lipinski's Rule of Five	1
Molar Refractivity	144.14
Topological Polar Surface Area	109.84
Polarizability	51.84
Ring Count	5
Rotatable Bond Count	6

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C26H21N5O2S		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00