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14673-46-2 | 4-Thiazolidinone, 3-amino-5-phenyl-2-thioxo-
CAS No: 14673-46-2 Catalog No: AG001EA4 MDL No:
Product Description
Catalog Number:
AG001EA4
Chemical Name:
4-Thiazolidinone, 3-amino-5-phenyl-2-thioxo-
CAS Number:
14673-46-2
Molecular Formula:
C9H8N2OS2
Molecular Weight:
224.3026
IUPAC Name:
3-amino-5-phenyl-2-sulfanylidene-1,3-thiazolidin-4-one
InChI:
InChI=1S/C9H8N2OS2/c10-11-8(12)7(14-9(11)13)6-4-2-1-3-5-6/h1-5,7H,10H2
InChI Key:
SEMNRDBNUVGEHQ-UHFFFAOYSA-N
SMILES:
NN1C(=S)SC(C1=O)c1ccccc1
Properties
Complexity:
264
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
224.008g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
224.296g/mol
Monoisotopic Mass:
224.008g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
104A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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