N-(1-chlorobutan-2-yl)-N-(2-chloroethyl)-[[(2R,3S,4R,5R)-5-(3,5-dioxo-1,2,4-triazin-2-yl)-3,4-dihydroxyoxolan-2-yl]methoxy]phosphonamidic acid
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![N-(1-chlorobutan-2-yl)-N-(2-chloroethyl)-[[(2R,3S,4R,5R)-5-(3,5-dioxo-1,2,4-triazin-2-yl)-3,4-dihydroxyoxolan-2-yl]methoxy]phosphonamidic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/72178a7b11fb4627883b62e7b2f85a0b.png "N-(1-chlorobutan-2-yl)-N-(2-chloroethyl)-[[(2R,3S,4R,5R)-5-(3,5-dioxo-1,2,4-triazin-2-yl)-3,4-dihydroxyoxolan-2-yl]methoxy]phosphonamidic acid")
N-(1-chlorobutan-2-yl)-N-(2-chloroethyl)-[[(2R,3S,4R,5R)-5-(3,5-dioxo-1,2,4-triazin-2-yl)-3,4-dihydroxyoxolan-2-yl]methoxy]phosphonamidic acid
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CAS No:
20603-61-6
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Formula:
C14H23Cl2N4O8P
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Chemical Name:
N-(1-chlorobutan-2-yl)-N-(2-chloroethyl)-[[(2R,3S,4R,5R)-5-(3,5-dioxo-1,2,4-triazin-2-yl)-3,4-dihydroxyoxolan-2-yl]methoxy]phosphonamidic acid
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Synonyms:
20603-61-6;BRN 0728101;DTXSID20942791;Ethyl(6-azauridine-5')-bis-(2-chloroethyl)amidophosphate;as-Triazine-3,5(2H,4H)-dione, 2-beta-D-ribofuranosyl-, 5'-(ethylbis(2-chloroethyl)phosphoramidate);2-(5-O-{[(1-Chlorobutan-2-yl)(2-chloroethyl)amino](hydroxy)phosphoryl}pentofuranosyl)-5-hydroxy-1,2,4-triazin-3(2H)-one
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CAS No:
N-(1-chlorobutan-2-yl)-N-(2-chloroethyl)-[[(2R,3S,4R,5R)-5-(3,5-dioxo-1,2,4-triazin-2-yl)-3,4-dihydroxyoxolan-2-yl]methoxy]phosphonamidic acid Basic Attributes
477.2 g/mol
476.0630561 g/mol
Computed Properties
Molecular Weight:477.2
XLogP3:-0.9
Hydrogen Bond Donor Count:4
Hydrogen Bond Acceptor Count:10
Rotatable Bond Count:10
Exact Mass:476.0630561
Monoisotopic Mass:476.0630561
Topological Polar Surface Area:161
Heavy Atom Count:29
Complexity:686
Defined Atom Stereocenter Count:4
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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