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1-[4-(2-hydroxy-3-naphthalen-1-yloxypropyl)piperazin-1-yl]-3-naphthalen-1-yloxypropan-2-ol
1-[4-(2-hydroxy-3-naphthalen-1-yloxypropyl)piperazin-1-yl]-3-naphthalen-1-yloxypropan-2-ol
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![1-[4-(2-hydroxy-3-naphthalen-1-yloxypropyl)piperazin-1-yl]-3-naphthalen-1-yloxypropan-2-ol structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/9b3d28f9ce804631b41318a48a9ab7ff.png "1-[4-(2-hydroxy-3-naphthalen-1-yloxypropyl)piperazin-1-yl]-3-naphthalen-1-yloxypropan-2-ol")
1-[4-(2-hydroxy-3-naphthalen-1-yloxypropyl)piperazin-1-yl]-3-naphthalen-1-yloxypropan-2-ol
structure -
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CAS No:
5550-75-4
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Formula:
C30H34N2O4
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Chemical Name:
1-[4-(2-hydroxy-3-naphthalen-1-yloxypropyl)piperazin-1-yl]-3-naphthalen-1-yloxypropan-2-ol
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Synonyms:
T0500-3416; Ergotaminin; 5'-benzyl-12'-hydroxy-2'-methyl-9,10-dihydro-ergotamane-18,3',6'-trione; Dihydroergotamin; 2`-Epidihydroergotamine;
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CAS No:
1-[4-(2-hydroxy-3-naphthalen-1-yloxypropyl)piperazin-1-yl]-3-naphthalen-1-yloxypropan-2-ol Basic Attributes
486.60200
486.25185757
DTXSID90389735
Computed Properties
Molecular Weight:486.6
XLogP3:4.7
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:10
Exact Mass:486.25185757
Monoisotopic Mass:486.25185757
Topological Polar Surface Area:65.4
Heavy Atom Count:36
Complexity:588
Undefined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
Guide of 1-[4-(2-hydroxy-3-naphthalen-1-yloxypropyl)piperazin-1-yl]-3-naphthalen-1-yloxypropan-2-ol
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