methyl (2S)-2-[[[(2S,3S,5R)-3-azido-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy-ethoxyphosphoryl]amino]propanoate
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methyl (2S)-2-[[[(2S,3S,5R)-3-azido-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy-ethoxyphosphoryl]amino]propanoate
structure -
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CAS No:
133201-13-5
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Formula:
C16H25N6O8P
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Chemical Name:
methyl (2S)-2-[[[(2S,3S,5R)-3-azido-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy-ethoxyphosphoryl]amino]propanoate
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Synonyms:
L-Alanine, N-(3'-azido-3'-deoxy-P-ethyl-5'-thymidylyl)-, methyl ester, (R)-;133201-13-5;5'-(O-Ethyl-N-(methoxycarbonylethyl)phosphoramidate)-3'-azido-3'-deoxythymidine;5'-[O-Ethyl-N-(methoxycarbonylethyl)phosphoramidate)-3'-azido-3'-deoxythymidine;methyl (2S)-2-[[[(2S,3S,5R)-3-azido-5-(5-methyl-2,4-dioxo-pyrimidin-1-yl)tetrahydrofuran-2-yl]methoxy-ethoxy-phosphoryl]amino]propanoate
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CAS No:
methyl (2S)-2-[[[(2S,3S,5R)-3-azido-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy-ethoxyphosphoryl]amino]propanoate Basic Attributes
460.38 g/mol
460.14714877 g/mol
Computed Properties
Molecular Weight:460.38
XLogP3:0.4
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:11
Rotatable Bond Count:11
Exact Mass:460.14714877
Monoisotopic Mass:460.14714877
Topological Polar Surface Area:147
Heavy Atom Count:31
Complexity:844
Defined Atom Stereocenter Count:4
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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