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369651-02-5 | 3-Thiazolidinecarboxamide, 5-methylene-N-octadecyl-2-thioxo-
CAS No: 369651-02-5 Catalog No: AG007CJT MDL No:
Product Description
Catalog Number:
AG007CJT
Chemical Name:
3-Thiazolidinecarboxamide, 5-methylene-N-octadecyl-2-thioxo-
CAS Number:
369651-02-5
Molecular Formula:
C23H42N2OS2
Molecular Weight:
426.7224
IUPAC Name:
5-methylidene-N-octadecyl-2-sulfanylidene-1,3-thiazolidine-3-carboxamide
InChI:
InChI=1S/C23H42N2OS2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-24-22(26)25-20-21(2)28-23(25)27/h2-20H2,1H3,(H,24,26)
InChI Key:
SVNXWTSGALQBQQ-UHFFFAOYSA-N
SMILES:
CCCCCCCCCCCCCCCCCCNC(=O)N1CC(=C)SC1=S
Properties
Complexity:
454
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
426.274g/mol
Formal Charge:
0
Heavy Atom Count:
28
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
426.722g/mol
Monoisotopic Mass:
426.274g/mol
Rotatable Bond Count:
17
Topological Polar Surface Area:
89.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
9.8
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