3-Thiazolidineacetic acid,5-[[4-[4-(2,2-diphenylethenyl)phenyl]-1,2,3,3a,4,8b-hexahydrocyclopent[b]indol-7-yl]methylene]-2-(3-ethyl-4-oxo-2-thioxo-5-thiazolidinylidene)-4-oxo-


Chemical Name: 3-Thiazolidineacetic acid,5-[[4-[4-(2,2-diphenylethenyl)phenyl]-1,2,3,3a,4,8b-hexahydrocyclopent[b]indol-7-yl]methylene]-2-(3-ethyl-4-oxo-2-thioxo-5-thiazolidinylidene)-4-oxo-
CAS Number: 786643-20-7
Product Number: AG003MB2(AGN-PC-0UDPOK)
Synonyms:
MDL No:
Molecular Formula: C42H35N3O4S3
Molecular Weight: 741.9400

Identification/Properties


Properties
MP:
284-289℃
Storage:
-10 ℃;
Form:
Solid
Computed Properties
Molecular Weight:
741.939g/mol
XLogP3:
9.7
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
8
Rotatable Bond Count:
8
Exact Mass:
741.179g/mol
Monoisotopic Mass:
741.179g/mol
Topological Polar Surface Area:
164A^2
Heavy Atom Count:
52
Formal Charge:
0
Complexity:
1480
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
2
Defined Bond Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
Signal Word:
Warning
UN#:
-
Hazard Statements:
H302-H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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