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(5E)-3-[(2,6-dichlorophenyl)methyl]-5-(naphthalen-1-ylmethylidene)-1,3-thiazolidine-2,4-dione

(5E)-3-[(2,6-dichlorophenyl)methyl]-5-(naphthalen-1-ylmethylidene)-1,3-thiazolidine-2,4-dione

Formula: C21H13Cl2NO2S

SMILES: ClC1=CC=CC(Cl)=C1CN1C(=O)SC(=CC2=CC=CC3=CC=CC=C23)C1=O

IUPAC: (5E)-3-[(2,6-dichlorophenyl)methyl]-5-[(naphthalen-1-yl)methylidene]-1,3-thiazolidine-2,4-dione

InChI: InChI=1S/C21H13Cl2NO2S/c22-17-9-4-10-18(23)16(17)12-24-20(25)19(27-21(24)26)11-14-7-3-6-13-5-1-2-8-15(13)14/h1-11H,12H2/b19-11+

Composition: C (60.88%), H (3.16%), Cl (17.11%), N (3.38%), O (7.72%), S (7.74%)

Molar Mass: 414.3

Atom Count: 40

Heavy Atom Count: 27

Properties
Properties
Common Names N/A
Aromatic Ring Count 3
Asymmetric Atom Count 0
Exact Mass 413.0044052
Formal Charge 0
FSP3 0.05
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 0
InChIKey WQJOFTDKGOXWSL-YBFXNURJSA-N
Lipinski's Rule of Five
Molar Refractivity 111.79
Topological Polar Surface Area 37.38
Polarizability 43.78
Ring Count 4
Rotatable Bond Count 3

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C21H13Cl2NO2S $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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