Text Search
Structure Search

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

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

Formula: C22H19ClFNO4S

SMILES: CCOC1=CC(C=C2/SC(=O)N(CC3=CC=C(F)C=C3)C2=O)=CC(Cl)=C1OCC=C

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

InChI: InChI=1S/C22H19ClFNO4S/c1-3-9-29-20-17(23)10-15(11-18(20)28-4-2)12-19-21(26)25(22(27)30-19)13-14-5-7-16(24)8-6-14/h3,5-8,10-12H,1,4,9,13H2,2H3/b19-12-

Composition: C (59.00%), H (4.28%), Cl (7.91%), F (4.24%), N (3.13%), O (14.29%), S (7.16%)

Molar Mass: 447.91

Atom Count: 49

Heavy Atom Count: 30

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 447.0707351
Formal Charge 0
FSP3 0.18
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 0
InChIKey UDGAXPRWOLJBBQ-UNOMPAQXSA-N
Lipinski's Rule of Five
Molar Refractivity 117.59
Topological Polar Surface Area 55.84
Polarizability 44.47
Ring Count 3
Rotatable Bond Count 8

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C22H19ClFNO4S $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
Request Quote