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477858-70-1 | N'-[(1Z)-1-(4-methylphenyl)ethylidene]-1-(6-methylpyridin-2-yl)-1H-imidazole-4-carbohydrazide
CAS No: 477858-70-1 Catalog No: AG00IPTQ MDL No:MFCD02082697
Product Description
Catalog Number:
AG00IPTQ
Chemical Name:
N'-[(1Z)-1-(4-methylphenyl)ethylidene]-1-(6-methylpyridin-2-yl)-1H-imidazole-4-carbohydrazide
CAS Number:
477858-70-1
Molecular Formula:
C19H19N5O
Molecular Weight:
333.3871
MDL Number:
MFCD02082697
IUPAC Name:
N-[1-(4-methylphenyl)ethylideneamino]-1-(6-methylpyridin-2-yl)imidazole-4-carboxamide
InChI:
InChI=1S/C19H19N5O/c1-13-7-9-16(10-8-13)15(3)22-23-19(25)17-11-24(12-20-17)18-6-4-5-14(2)21-18/h4-12H,1-3H3,(H,23,25)
InChI Key:
FKAPDOSZPPISFV-UHFFFAOYSA-N
SMILES:
Cc1ccc(cc1)/C(=N\NC(=O)c1ncn(c1)c1cccc(n1)C)/C
Properties
Complexity:
486
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
333.159g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
333.395g/mol
Monoisotopic Mass:
333.159g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
72.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
3.2
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