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88324-04-3 | Ethanone, 1-[4-methyl-2-[(4-methylphenyl)amino]-5-thiazolyl]-, oxime
CAS No: 88324-04-3 Catalog No: AG0047E4 MDL No:
Product Description
Catalog Number:
AG0047E4
Chemical Name:
Ethanone, 1-[4-methyl-2-[(4-methylphenyl)amino]-5-thiazolyl]-, oxime
CAS Number:
88324-04-3
Molecular Formula:
C13H15N3OS
Molecular Weight:
261.3427
IUPAC Name:
N-[1-[4-methyl-2-(4-methylanilino)-1,3-thiazol-5-yl]ethylidene]hydroxylamine
InChI:
InChI=1S/C13H15N3OS/c1-8-4-6-11(7-5-8)15-13-14-9(2)12(18-13)10(3)16-17/h4-7,17H,1-3H3,(H,14,15)
InChI Key:
VZGJNDFTVJLIMT-UHFFFAOYSA-N
SMILES:
ON=C(c1sc(nc1C)Nc1ccc(cc1)C)C
Properties
Complexity:
303
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
261.094g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
261.343g/mol
Monoisotopic Mass:
261.094g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
85.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
3.9
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