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6-amino-4-(4-fluorophenyl)-3-propyl-2H,4H-pyrano[2,3-c]pyrazole-5-carbonitrile

6-amino-4-(4-fluorophenyl)-3-propyl-2H,4H-pyrano[2,3-c]pyrazole-5-carbonitrile

Formula: C16H15FN4O

SMILES: CCCC1=C2C(C3=CC=C(F)C=C3)C(C#N)=C(N)OC2=NN1

IUPAC: 6-amino-4-(4-fluorophenyl)-3-propyl-2H,4H-pyrano[2,3-c]pyrazole-5-carbonitrile

InChI: InChI=1/C16H15FN4O/c1-2-3-12-14-13(9-4-6-10(17)7-5-9)11(8-18)15(19)22-16(14)21-20-12/h4-7,13H,2-3,19H2,1H3,(H,20,21)

Composition: C (64.42%), H (5.07%), F (6.37%), N (18.78%), O (5.36%)

Molar Mass: 298.321

Atom Count: 37

Heavy Atom Count: 22

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 1
Exact Mass 298.122989282
Formal Charge 0
FSP3 0.25
Hetero Ring Count 2
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 2
InChIKey HUELBXZTLCJZCA-UHFFFAOYNA-N
Lipinski's Rule of Five 1
Molar Refractivity 91.58
Topological Polar Surface Area 87.72
Polarizability 29.91
Ring Count 3
Rotatable Bond Count 3

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C16H15FN4O $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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