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151504-48-2 | 4-hydroxy-6-methyl-3-[(1E)-1-[2-(4-phenyl-1,3-thiazol-2-yl)hydrazin-1-ylidene]ethyl]-2H-pyran-2-one
CAS No: 151504-48-2 Catalog No: AG00IQEZ MDL No:MFCD00141236
Product Description
Catalog Number:
AG00IQEZ
Chemical Name:
4-hydroxy-6-methyl-3-[(1E)-1-[2-(4-phenyl-1,3-thiazol-2-yl)hydrazin-1-ylidene]ethyl]-2H-pyran-2-one
CAS Number:
151504-48-2
Molecular Formula:
C17H15N3O3S
Molecular Weight:
341.3843
MDL Number:
MFCD00141236
IUPAC Name:
4-hydroxy-6-methyl-3-[C-methyl-N-[(4-phenyl-1,3-thiazol-2-yl)amino]carbonimidoyl]pyran-2-one
InChI:
InChI=1S/C17H15N3O3S/c1-10-8-14(21)15(16(22)23-10)11(2)19-20-17-18-13(9-24-17)12-6-4-3-5-7-12/h3-9,21H,1-2H3,(H,18,20)
InChI Key:
JRTFHZCWCWWGJO-UHFFFAOYSA-N
SMILES:
Cc1cc(O)c(c(=O)o1)/C(=N/Nc1scc(n1)c1ccccc1)/C
Properties
Complexity:
594
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
341.083g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
341.385g/mol
Monoisotopic Mass:
341.083g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
112A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
3.6
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