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154496-67-0 | Benzaldehyde,2-[6-methyl-2-[(1-methylethyl)thio]-4-pyrimidinyl]hydrazone
CAS No: 154496-67-0 Catalog No: AG007G2Y MDL No:
Product Description
Catalog Number:
AG007G2Y
Chemical Name:
Benzaldehyde,2-[6-methyl-2-[(1-methylethyl)thio]-4-pyrimidinyl]hydrazone
CAS Number:
154496-67-0
Molecular Formula:
C15H18N4S
Molecular Weight:
286.3952
IUPAC Name:
N-[(E)-benzylideneamino]-6-methyl-2-propan-2-ylsulfanylpyrimidin-4-amine
InChI:
InChI=1S/C15H18N4S/c1-11(2)20-15-17-12(3)9-14(18-15)19-16-10-13-7-5-4-6-8-13/h4-11H,1-3H3,(H,17,18,19)/b16-10+
InChI Key:
VOQBIOCAYWRAMG-MHWRWJLKSA-N
SMILES:
CC(Sc1nc(NN=Cc2ccccc2)cc(n1)C)C
Properties
Complexity:
302
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Exact Mass:
286.125g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
286.397g/mol
Monoisotopic Mass:
286.125g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
75.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.2
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