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(5Z)-5-{[5-bromo-2-(prop-2-en-1-yloxy)phenyl]methylidene}-3-[(2-chloro-6-fluorophenyl)methyl]-1,3-thiazolidine-2,4-dione

(5Z)-5-{[5-bromo-2-(prop-2-en-1-yloxy)phenyl]methylidene}-3-[(2-chloro-6-fluorophenyl)methyl]-1,3-thiazolidine-2,4-dione

Formula: C20H14BrClFNO3S

SMILES: FC1=C(CN2C(=O)SC(=C/C3=CC(Br)=CC=C3OCC=C)C2=O)C(Cl)=CC=C1

IUPAC: (5Z)-5-{[5-bromo-2-(prop-2-en-1-yloxy)phenyl]methylidene}-3-[(2-chloro-6-fluorophenyl)methyl]-1,3-thiazolidine-2,4-dione

InChI: InChI=1S/C20H14BrClFNO3S/c1-2-8-27-17-7-6-13(21)9-12(17)10-18-19(25)24(20(26)28-18)11-14-15(22)4-3-5-16(14)23/h2-7,9-10H,1,8,11H2/b18-10-

Composition: C (49.76%), H (2.92%), Br (16.55%), Cl (7.34%), F (3.94%), N (2.90%), O (9.94%), S (6.64%)

Molar Mass: 482.75

Atom Count: 42

Heavy Atom Count: 28

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 480.955033
Formal Charge 0
FSP3 0.1
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 0
InChIKey JKAMPASVKJBYDH-ZDLGFXPLSA-N
Lipinski's Rule of Five
Molar Refractivity 114
Topological Polar Surface Area 46.61
Polarizability 42.94
Ring Count 3
Rotatable Bond Count 6

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C20H14BrClFNO3S $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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