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89153-93-5 | Methanone, (3-chlorophenyl)[2-[(3-nitro-2-pyridinyl)amino]phenyl]-
CAS No: 89153-93-5 Catalog No: AG003WS4 MDL No:
Product Description
Catalog Number:
AG003WS4
Chemical Name:
Methanone, (3-chlorophenyl)[2-[(3-nitro-2-pyridinyl)amino]phenyl]-
CAS Number:
89153-93-5
Molecular Formula:
C18H12ClN3O3
Molecular Weight:
353.7592
IUPAC Name:
(3-chlorophenyl)-[2-[(3-nitropyridin-2-yl)amino]phenyl]methanone
InChI:
InChI=1S/C18H12ClN3O3/c19-13-6-3-5-12(11-13)17(23)14-7-1-2-8-15(14)21-18-16(22(24)25)9-4-10-20-18/h1-11H,(H,20,21)
InChI Key:
QAAYIFNMUCNMCD-UHFFFAOYSA-N
SMILES:
Clc1cccc(c1)C(=O)c1ccccc1Nc1ncccc1[N+](=O)[O-]
Properties
Complexity:
485
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
353.057g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
353.762g/mol
Monoisotopic Mass:
353.057g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
87.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.1
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