methyl 4-[[3-[[2-amino-6-(ethoxycarbonylamino)-3-nitropyridin-4-yl]amino]-2-oxopropyl]-methylamino]benzoate
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methyl 4-[[3-[[2-amino-6-(ethoxycarbonylamino)-3-nitropyridin-4-yl]amino]-2-oxopropyl]-methylamino]benzoate
structure -
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CAS No:
30826-44-9
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Formula:
C20H24N6O7
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Chemical Name:
methyl 4-[[3-[[2-amino-6-(ethoxycarbonylamino)-3-nitropyridin-4-yl]amino]-2-oxopropyl]-methylamino]benzoate
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Synonyms:
30826-44-9;NSC127070;SCHEMBL13342779;DTXSID80953025;NSC-127070;Benzoic acid, 4-[[3-[[2-amino-6-[(ethoxycarbonyl)amino]-3-nitro-4-pyridinyl]amino]-2-oxopropyl]methylamino]-, methyl ester;methyl 4-[[3-[[2-amino-6-(ethoxycarbonylamino)-3-nitro-4-pyridyl]amino]-2-oxo-propyl]-methyl-amino]benzoate;Methyl 4-[{3-[(2-amino-6-{[ethoxy(hydroxy)methylidene]amino}-3-nitropyridin-4-yl)amino]-2-oxopropyl}(methyl)amino]benzoate
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CAS No:
methyl 4-[[3-[[2-amino-6-(ethoxycarbonylamino)-3-nitropyridin-4-yl]amino]-2-oxopropyl]-methylamino]benzoate Basic Attributes
460.4 g/mol
460.17064713 g/mol
127070
Computed Properties
Molecular Weight:460.4
XLogP3:3.2
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:11
Rotatable Bond Count:11
Exact Mass:460.17064713
Monoisotopic Mass:460.17064713
Topological Polar Surface Area:182
Heavy Atom Count:33
Complexity:695
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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