Text Search
Structure Search

(4E)-4-({3-bromo-4-[(4-fluorophenyl)methoxy]-5-methoxyphenyl}methylidene)-1-phenylpyrazolidine-3,5-dione

(4E)-4-({3-bromo-4-[(4-fluorophenyl)methoxy]-5-methoxyphenyl}methylidene)-1-phenylpyrazolidine-3,5-dione

Formula: C24H18BrFN2O4

SMILES: COC1=CC(C=C2/C(=O)NN(C2=O)C2=CC=CC=C2)=CC(Br)=C1OCC1=CC=C(F)C=C1

IUPAC: (4E)-4-({3-bromo-4-[(4-fluorophenyl)methoxy]-5-methoxyphenyl}methylidene)-1-phenylpyrazolidine-3,5-dione

InChI: InChI=1S/C24H18BrFN2O4/c1-31-21-13-16(12-20(25)22(21)32-14-15-7-9-17(26)10-8-15)11-19-23(29)27-28(24(19)30)18-5-3-2-4-6-18/h2-13H,14H2,1H3,(H,27,29)/b19-11+

Composition: C (57.96%), H (3.65%), Br (16.07%), F (3.82%), N (5.63%), O (12.87%)

Molar Mass: 497.32

Atom Count: 50

Heavy Atom Count: 32

Properties
Properties
Common Names N/A
Aromatic Ring Count 3
Asymmetric Atom Count 0
Exact Mass 496.043398
Formal Charge 0
FSP3 0.08
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 1
InChIKey PLRJGXRRGBJLPV-YBFXNURJSA-N
Lipinski's Rule of Five 1
Molar Refractivity 121.23
Topological Polar Surface Area 67.87
Polarizability 45.84
Ring Count 4
Rotatable Bond Count 6

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C24H18BrFN2O4 $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
Request Quote