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Home > Imidazoles > 478077-74-6
478077-74-6 | 1-(6-methylpyridin-2-yl)-N'-[(1Z)-(4-nitrophenyl)methylidene]-1H-imidazole-4-carbohydrazide
CAS No: 478077-74-6 Catalog No: AG00IYSK MDL No:MFCD01871688
Product Description
Catalog Number:
AG00IYSK
Chemical Name:
1-(6-methylpyridin-2-yl)-N'-[(1Z)-(4-nitrophenyl)methylidene]-1H-imidazole-4-carbohydrazide
CAS Number:
478077-74-6
Molecular Formula:
C17H14N6O3
Molecular Weight:
350.3315
MDL Number:
MFCD01871688
IUPAC Name:
1-(6-methylpyridin-2-yl)-N-[(4-nitrophenyl)methylideneamino]imidazole-4-carboxamide
InChI:
InChI=1S/C17H14N6O3/c1-12-3-2-4-16(20-12)22-10-15(18-11-22)17(24)21-19-9-13-5-7-14(8-6-13)23(25)26/h2-11H,1H3,(H,21,24)
InChI Key:
HCBXHKGPDQMSCM-UHFFFAOYSA-N
SMILES:
Cc1cccc(n1)n1cnc(c1)C(=O)N/N=C\c1ccc(cc1)[N+](=O)[O-]
Properties
Complexity:
529
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
350.113g/mol
Formal Charge:
0
Heavy Atom Count:
26
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
350.338g/mol
Monoisotopic Mass:
350.113g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
118A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
2.4
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