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821782-90-5 | 4-Thiazolidinone, 5-methyl-2-(2-phenylethenyl)-3-(2-pyrimidinyl)-
CAS No: 821782-90-5 Catalog No: AG00516D MDL No:
Product Description
Catalog Number:
AG00516D
Chemical Name:
4-Thiazolidinone, 5-methyl-2-(2-phenylethenyl)-3-(2-pyrimidinyl)-
CAS Number:
821782-90-5
Molecular Formula:
C16H15N3OS
Molecular Weight:
297.3748
IUPAC Name:
5-methyl-2-(2-phenylethenyl)-3-pyrimidin-2-yl-1,3-thiazolidin-4-one
InChI:
InChI=1S/C16H15N3OS/c1-12-15(20)19(16-17-10-5-11-18-16)14(21-12)9-8-13-6-3-2-4-7-13/h2-12,14H,1H3
InChI Key:
CKNPJZRWDJACIA-UHFFFAOYSA-N
SMILES:
CC1SC(N(C1=O)c1ncccn1)C=Cc1ccccc1
Properties
Complexity:
389
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
297.094g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
297.376g/mol
Monoisotopic Mass:
297.094g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
71.4A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
1
XLogP3:
3
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