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14230-03-6 | 4-Thiazolidinone, 3-methyl-2-(phenylimino)-5-(phenylmethylene)-
CAS No: 14230-03-6 Catalog No: AG001I58 MDL No:
Product Description
Catalog Number:
AG001I58
Chemical Name:
4-Thiazolidinone, 3-methyl-2-(phenylimino)-5-(phenylmethylene)-
CAS Number:
14230-03-6
Molecular Formula:
C17H14N2OS
Molecular Weight:
294.3709
IUPAC Name:
5-benzylidene-3-methyl-2-phenylimino-1,3-thiazolidin-4-one
InChI:
InChI=1S/C17H14N2OS/c1-19-16(20)15(12-13-8-4-2-5-9-13)21-17(19)18-14-10-6-3-7-11-14/h2-12H,1H3
InChI Key:
CFMUOLUOOGBKKC-UHFFFAOYSA-N
SMILES:
CN1C(=Nc2ccccc2)SC(=Cc2ccccc2)C1=O
Properties
Complexity:
446
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
294.083g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
294.372g/mol
Monoisotopic Mass:
294.083g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
58A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
4.2
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