N'-[4-[4-[bis(2-chloroethyl)amino]phenyl]butanoyl]-9a-hydroxy-3-oxo-2-propan-2-yl-6,7,8,9-tetrahydro-5H-[1,3]oxazolo[3,2-a]azepine-2-carbohydrazide
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![N'-[4-[4-[bis(2-chloroethyl)amino]phenyl]butanoyl]-9a-hydroxy-3-oxo-2-propan-2-yl-6,7,8,9-tetrahydro-5H-[1,3]oxazolo[3,2-a]azepine-2-carbohydrazide structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/e50379dc313f4a7cbe70b93ad0478fc3.png "N'-[4-[4-[bis(2-chloroethyl)amino]phenyl]butanoyl]-9a-hydroxy-3-oxo-2-propan-2-yl-6,7,8,9-tetrahydro-5H-[1,3]oxazolo[3,2-a]azepine-2-carbohydrazide")
N'-[4-[4-[bis(2-chloroethyl)amino]phenyl]butanoyl]-9a-hydroxy-3-oxo-2-propan-2-yl-6,7,8,9-tetrahydro-5H-[1,3]oxazolo[3,2-a]azepine-2-carbohydrazide
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CAS No:
60807-08-1
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Formula:
C26H38Cl2N4O5
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Chemical Name:
N'-[4-[4-[bis(2-chloroethyl)amino]phenyl]butanoyl]-9a-hydroxy-3-oxo-2-propan-2-yl-6,7,8,9-tetrahydro-5H-[1,3]oxazolo[3,2-a]azepine-2-carbohydrazide
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Synonyms:
60807-08-1;NSC168826;DTXSID90305031;NSC-168826;N'-(4-{4-[Bis(2-chloroethyl)amino]phenyl}butanoyl)-9a-hydroxy-3-oxo-2-(propan-2-yl)octahydro[1,3]oxazolo[3,2-a]azepine-2-carbohydrazide;Oxazolo[3, octahydro-9a-hydroxy-2-(1-methylethyl)-3-oxo-, 2-[4-[4-[bis(2-chloroethyl)amino]phenyl]-1-oxobutyl]hydrazide
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CAS No:
N'-[4-[4-[bis(2-chloroethyl)amino]phenyl]butanoyl]-9a-hydroxy-3-oxo-2-propan-2-yl-6,7,8,9-tetrahydro-5H-[1,3]oxazolo[3,2-a]azepine-2-carbohydrazide Basic Attributes
557.5 g/mol
556.2219257 g/mol
168826
DTXSID90305031
Computed Properties
Molecular Weight:557.5
XLogP3:4.3
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:11
Exact Mass:556.2219257
Monoisotopic Mass:556.2219257
Topological Polar Surface Area:111
Heavy Atom Count:37
Complexity:789
Undefined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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