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5199-12-2 | 3-Methyl-5-(piperidinomethylene)-2-thioxothiazolidin-4-one
CAS No: 5199-12-2 Catalog No: AG00E0M3 MDL No:
Product Description
Catalog Number:
AG00E0M3
Chemical Name:
3-Methyl-5-(piperidinomethylene)-2-thioxothiazolidin-4-one
CAS Number:
5199-12-2
IUPAC Name:
(5E)-3-methyl-5-(piperidin-1-ylmethylidene)-2-sulfanylidene-1,3-thiazolidin-4-one
InChI:
InChI=1S/C10H14N2OS2/c1-11-9(13)8(15-10(11)14)7-12-5-3-2-4-6-12/h7H,2-6H2,1H3/b8-7+
InChI Key:
YHQIVJYVWFEHBL-BQYQJAHWSA-N
Properties
Complexity:
321
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Exact Mass:
242.055g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
242.355g/mol
Monoisotopic Mass:
242.055g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
80.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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