Text Search
Structure Search

(5Z)-5-[(3-methoxy-4-{2-[3-(trifluoromethyl)phenoxy]ethoxy}phenyl)methylidene]-3-methyl-2-sulfanylidene-1,3-thiazolidin-4-one

(5Z)-5-[(3-methoxy-4-{2-[3-(trifluoromethyl)phenoxy]ethoxy}phenyl)methylidene]-3-methyl-2-sulfanylidene-1,3-thiazolidin-4-one

Formula: C21H18F3NO4S2

SMILES: COC1=CC(C=C2/SC(=S)N(C)C2=O)=CC=C1OCCOC1=CC=CC(=C1)C(F)(F)F

IUPAC: (5Z)-5-[(3-methoxy-4-{2-[3-(trifluoromethyl)phenoxy]ethoxy}phenyl)methylidene]-3-methyl-2-sulfanylidene-1,3-thiazolidin-4-one

InChI: InChI=1S/C21H18F3NO4S2/c1-25-19(26)18(31-20(25)30)11-13-6-7-16(17(10-13)27-2)29-9-8-28-15-5-3-4-14(12-15)21(22,23)24/h3-7,10-12H,8-9H2,1-2H3/b18-11-

Composition: C (53.72%), H (3.86%), F (12.14%), N (2.98%), O (13.63%), S (13.66%)

Molar Mass: 469.49

Atom Count: 49

Heavy Atom Count: 31

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 469.062934901
Formal Charge 0
FSP3 0.24
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 0
InChIKey RBKXTJIGYUFMLP-WQRHYEAKSA-N
Lipinski's Rule of Five
Molar Refractivity 118.56
Topological Polar Surface Area 48
Polarizability 44.5
Ring Count 3
Rotatable Bond Count 8

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
| Clear Filters
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C21H18F3NO4S2 $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
Request Quote